X-Ray Sources and Detectors Found in
Acta Crystallographica Section E, 59 (2003)
Summary
A total of manuscripts found in Acta E = 1297 (2003)
1. X-Ray source 2. Source type 3. Temp condition 4. Detector type
---------------------- ---------------------- --------------------------- -----------------------
Total = 1295 Total = 1164 Total = 1296 Total = 1293
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Mo = 1210 (93.4%) Tube = 1088 (94.5%) Room temp. = 804 (62.0%) AFC = 320 (24.7%)
Cu = 78 (6.0%) RA = 60 (5.2%) CCD = 824 (63.7%)
Neutron = 0 Neutron = 0 Controled = 492 (38.0%) IP = 136 (10.5%)
SR = 7 (0.5%) SR = 7 (0.6%) Multiwire= 0
Ag = 0 ---------------------- --------------------------- -----------------------
----------------------
SR=synchrotron; RA=rotating anode
Each manuscripts
E59 Part 1 EN=Enraf-Nonius; N=Nonius; R=Rigaku; B=Bruker; S=Siemens; 4C=four circle
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Page Auth Formula Mr SPG Temp Source Device Obs.REF Qmax Rint NREF Npar Data reduction Rall wRall Fraction
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m1-m2 Urs C33H57HfNO 790.3 P-1 293 MoKa tube B SMART CCD 21660 27.6 0.092 8429 463 SAINT 0.137 0.919
m3-m5 Tong C19H13N2Ni 680.7 P-1 293 MoKa tube B SMART CCD 6270 25.0 0.039 4322 302 SAINT 0.107 0.102 0.981
m6-m7 Jones C37H48F3N2 792.7 P212121 180 MoKa tube N KappaCCD 21982 25.0 0.049 6615 447 HKL DENZO and 0.052 0.083 0.996
m8-m10 Paz C32H34CoN4 693.6 P-1 180 MoKa tube N KappaCCD 5657 24.9 0.059 2574 234 HKL DENZO and 0.066 0.121 0.976
m11-m13 Fleischer C4H12Pb1 267.3 Pa-3 150 MoKa B SMART APEX CCD 7703 28.1 0.062 577 17 SAINT 0.048 0.105 0.975
m14-m16 Ivashkevich C20H24Cl2C 510.9 P-1 293 MoKa tube Nicolet R3m 4C 6068 27.6 0.014 5445 280 R3m Software 0.048 0.121 1.000
m17-m19 Lemoine C14H14Cl2C 360.7 P21 180 MoKa tube Stoe IPDS 5663 26.1 0.018 2499 225 XRED 0.018 0.046 0.917
m20-m22 Butcher C21H20CuN2 443.9 P-1 293 MoKa tube S P4S 4594 27.5 0.021 4347 262 XSCANS 0.039 0.082 0.990
m23-m25 Li C14H21Cl2C 457.8 P21/n 293 MoKa tube B APEX CCD 9413 25.5 0.056 3334 235 SAINT 0.047 0.069 0.997
m26-m28 Matsushita C8H36Cl2N8 1089.8 Ibam 295 MoKa tube R AFC-5S 3059 32.5 0.029 975 68 a handmade program 0.048 1.000
m29-m32 Ahmed C57H41EuN2 1001.9 P-1 153 MoKa RA B SMART CCD 102650 27.0 0.061 49686 2972 SAINT 0.102 0.095 0.990
m33-m35 Bratych C21H18Fe2O 398.1 P2/c 130 MoKa tube B SMART CCD 3879 25.0 0.078 1368 111 SAINT 0.037 0.094 0.997
m36-m37 Chee C64H54N4O6 1212.5 P21/c 168 MoKa tube B CCD 33422 26.4 0.026 5303 351 SAINT 0.022 0.048 0.990
m38-m40 Lyakhov C5H10Cl2Cu 260.6 P-1 293 MoKa tube Nicolet R3m 4C 3216 30.1 0.028 2961 112 R3m Software 0.039 0.098 0.999
m41-m43 Usman C18H18N4O4 483.9 Pna21 293 MoKa tube S SMART CCD 12903 28.3 0.020 3811 264 SAINT 0.030 0.060 0.998
m44-m45 Meij C36H42Cl2P 714.0 P21/n 293 MoKa B 1000 SMART 11930 28.3 0.050 4236 187 SAINT 0.106 0.986
m46-m49 Raj C18H28I2N2 995.7 C2/c 120 MoKa tube Kuma KM4 CCD 10398 25.1 0.036 2539 229 KM-4 CCD Soft 0.029 0.095 0.996
o1-o3 Jin C12H18N2O8 318.3 P21/n 293 MoKa tube S P4 2775 0.028 2631 200 SHELXTL 0.086 0.102
o4-o6 Raynal C14H19NO4 265.3 P21/c 293 MoKa tube N Kappa CCD 8934 26.4 0.033 2702 179 DENZO and SCA 0.059 0.128 0.946
o7-o8 Silva C6H12ClNO4 197.6 Pnma 293 CuKa tube EN CAD-4 1837 72.4 0.019 950 64 HELENA 0.059 0.163 0.999
o9-o10 Blake C24H24ClO2 410.9 P-1 150 MoKa tube B SMART1000 CCD 9902 27.5 0.027 5295 265 SAINT and SHE 0.051 0.098 0.890
o11-o13 Palusiak C17H18O4 286.3 P-1 293 CuKa tube R AFC-5S 2695 67.5 0.025 2505 239 TEXSAN' 0.049 0.114 0.970
o14-o17 Hemamalini C44H48N8O1 912.9 P-1 293 MoKa tube B SMART 16182 32.4 0.019 6741 395 SAINT 0.063 0.136 0.890
o18-o20 Low C26H21ClN4 456.9 P21/c 120 MoKa tube N KappaCCD 34725 27.5 0.067 9748 597 DENZO-SMN 0.102 0.150 0.989
o21-o23 Andrade C19H30O3 306.4 P21 293 CuKa tube EN MACH-3 3519 71.9 0.017 1827 208 HELENA 0.035 0.108 1.000
o24-o25 Jones C38H44O8 628.7 P1 178 MoKa tube Nicolet R3 4034 27.5 4034 421 XDISK 0.047 0.095 0.998
o26-o27 Zhang C14H12N2S4 336.5 P21/c 293 MoKa tube B CCD 3479 26.4 0.031 1518 91 SAINT and SHE 0.069 0.086 0.984
o28-o30 Sridhar C5H12ClNO6 217.6 P-1 105 MoKa tube B SMART CCD 35831 35.1 0.020 15604 485 SAINT 0.053 0.105 0.933
o31-o33 Rajagopal C7H12Cl3NO 312.6 P-1 123 MoKa tube B SMART 7442 27.5 0.019 2999 145 SAINT 0.034 0.092 0.990
o34-o35 Zheng C14H14N4S4 366.5 C2/c 293 MoKa tube B SMART CCD 2152 25.0 0.000 1497 101 SAINT 0.040 0.078 0.997
o36-o37 Deschamps C13H17NO7S 363.4 P-1 193 CuKa RA B SMART 6000 CCD 8699 67.2 0.033 4996 422 SAINT and XPR 0.044 0.115 0.835
o38-o40 Jones C20H24ClN3 373.9 P21 173 MoKa tube S P4 5792 25.0 0.041 5297 505 XSCANS 0.077 0.103 0.996
o41-o43 Jones C20H24ClN3 373.9 P212121 123 MoKa tube Stoe-Huber-S 61630 25.1 0.112 6553 500 SAINT 0.082 0.105 0.997
o44-o45 Thamotharan C14H13ClN2 308.7 P21/c 160 MoKa N FR591 t N KappaCCD 35568 30.0 0.051 4068 194 DENZO-SMN and 0.063 0.117 0.999
o46-o48 Cox C15H12O5 272.3 P21/n 120 MoKa EN KappaCCD 11748 27.5 0.158 2701 170 DENZO and COL 0.219 0.155 0.957
o49-o51 Sankaranara C26H21ClN2 461.0 P21/n 293 MoKa tube S SMART CCD 14665 28.3 0.031 5441 293 SAINT 0.068 0.124 0.934
o52-o53 Marciniak C10H8O 144.2 Cc 293 MoKa BSW tube DARCH-1 1875 27.5 0.020 1744 204 DARCH package 0.056 0.093 1.000
o54-o56 Baumer C18H16ClN3 405.8 P21/n 293 MoKa tube S P3/PC 3526 25.5 0.043 3297 256 XDISK and XPR 0.070 0.099 0.999
o57-o58 Decken C11H16N2O3 224.3 P-1 173 MoKa tube B SMART CCD 6121 32.5 0.012 3838 209 SHELXTL 0.065 0.113 0.973
o59-o60 Usman C15H8ClNO2 269.7 P21/c 293 MoKa tube S SMART CCD 7010 28.3 0.033 2823 204 SAINT 0.092 0.150 0.985
o61-o62 Clegg C15H15NO5 289.3 P21/c 295 MoKa tube Stoe-S 4C 2981 25.0 0.019 2558 194 local program 0.123 0.306 1.000
o63-o65 Gravestock C18H22N2O 282.4 P21/n 295 MoKa EN CAD-4 6534 25.0 0.067 2863 190 XCAD4 0.287 0.997
o66-o69 Low C16H15N5O 293.3 P-1 120 MoKa tube N KappaCCD 9646 25.0 0.050 3036 199 DENZO-SMN 0.052 0.110 0.936
o70-o71 Li C9H20O4S2 256.4 P-1 293 MoKa tube B SMART CCD 2545 25.0 0.014 2181 157 SAINT 0.053 0.112 0.990
o72-o74 Bats C13H16O3 220.3 Pna21 142 MoKa tube S SMART 1K CCD 37645 28.5 0.023 3878 294 SAINT 0.040 0.099 0.955
o75-o76 Thamotharan C11H12ClN3 253.7 P21/c 160 MoKa N FR590 t N KappaCCD 23311 27.5 0.081 2597 159 DENZO-SMN and 0.079 0.122 1.000
o77-o79 Andrau C13H16N2O4 264.3 P-1 130 MoKa tube B CCD 3614 27.5 0.032 2787 236 SAINT 0.060 0.097 0.916
o80-o82 Zou C13H11NO6 277.2 P21/n 293 MoKa tube B CCD 5185 25.5 0.084 2352 183 SAINT 0.122 0.187 0.990
o83-o85 Yogavel C26H36N4O4 468.6 P21/c 293 MoKa tube S SMART CCD 17219 28.7 0.043 6219 311 SAINT 0.107 0.190 0.950
o86-o88 Clegg C21H25NO6 387.4 P1 160 MoKa tube Stoe-S 4C 1795 25.0 0.038 1786 257 local program 0.032 0.081 0.998
o89-o91 Plater C20H9F5 344.3 P21/n 298 MoKa tube Nicolet P3 2772 25.1 0.031 2656 227 RDNIC 0.095 0.113 0.998
o92-o93 Jones C18H15N3S 305.4 P21/c 178 MoKa tube Nicolet R3 2987 25.0 0.015 2886 201 XDISK 0.092 0.161 0.998
o94-o96 Paixao C11H15NO3 209.2 P21/c 293 CuKa tube EN MACH3 3600 72.4 0.013 2187 145 HELENA 0.061 0.144 1.000
o97-o98 Bates C20H32O3 320.5 P21 170 MoKa tube B SMART CCD 15289 22.5 0.114 2580 419 SAINT and SHE 0.104 0.126 1.000
o99-o101 Sankaranara C42H30N2O4 754.9 P-1 293 MoKa tube S SMART CCD 6040 28.3 0.023 4138 235 SAINT 0.046 0.120 0.953
o102-o103 Qi C17H14N2O2 278.3 P21/n 294 MoKa tube S SMART CCD 9204 27.5 0.034 3167 192 SHELXTL-NT 0.078 0.111 0.996
o104-o105 Qi C16H11IN2O 374.2 P21/n 294 MoKa tube S SMART CCD 9337 27.6 0.031 3169 181 SHELXTL-NT 0.052 0.072 0.994
E59 Part 2
i1-i3 Cerny Si4Yb5 977.5 Pnma 2930.523 synchrotr 2-axis goniometer 46 FULLPROF99
i4-i6 Stoll Nb4O0.60Rb 1676.3 C2/c 293 MoKa tube Stoe IP System 15576 26.9 0.064 3889 173 IPDS Program 0.040 0.077 0.971
i7-i9 Hidouri Fe1.21Mg1. 437.5 C2/c 293 MoKa EN TurboCAD4 1138 28.0 0.014 1048 98 XCAD4 0.071 1.000
i10-i13 Kolitsch AlMo2NaO8 369.9 C2/c 293 MoKa tube N KappaCCD 1863 30.0 0.014 986 58 HKL DENZO and 0.017 0.043 0.997
i14-i16 Fabry H4.704F2K2 294.8 C2/c 293 MoKa tube N KappaCCD 5391 27.5 0.030 942 79 HKL DENZO and 0.021 0.054 0.991
i17-i19 Werner AlBaCaF7 337.4 P2/n 293 MoKa tube 5719 30.5 0.020 1603 93 SAINT 0.022 0.044 0.966
i20-i21 Lerner H2ClLiO 60.4 Cmcm 173 MoKa tube Stoe IPDS-II 2C 3852 29.2 0.049 349 25 X-AREA 0.020 0.047 0.980
i22-i24 Barrier MoO7Pr3 630.7 P212121 293 MoKa tube N KappaCCD 16521 37.8 0.058 3345 101 DENZO and SCA 0.031 0.067 0.998
m50-m52 Chen C18AuClF15 764.6 P21/n 183 MoKa tube B AXS SMART CCD 33627 30.0 0.035 11871 649 SHELXTL 0.049 0.074 0.996
m53-m54 Ho C24H26AuO4 670.5 C2/c 208 MoKa tube B AXS SMART CCD 20818 30.0 0.039 7255 289 SHELXTL 0.038 0.068 0.993
m55-m56 Hu C24H10Fe4O 809.9 P21/n 293 MoKa tube S SMART CCD 9335 25.1 0.038 5418 388 XPREP in SHELXTL 0.147 0.990
m57-m58 Hossain C12H24AuCl 571.3 P21/n 100 MoKa tube B APEX 7528 26.0 0.019 2800 103 SAINT 0.020 0.047 0.986
m59-m60 Guo C12H8AgN5O 394.1 P-1 298 MoKa B SMART 1000 2737 22.5 0.021 2303 199 0.045 0.117 0.992
m61-m63 Butcher C21H24CuN2 416.0 Cc 293 MoKa tube S P4S 3692 32.5 0.000 3609 245 XSCANS 0.053 0.082 0.998
m64-m66 Clegg C32H72Li4N 704.6 P-1 160 MoKa tube B SMART 1K CCD 32571 25.0 0.017 22410 1370 SAINT 0.060 0.094 0.936
m67-m68 Vasiliev C2H2KN5O2 167.2 P21/c 293 CuKa tube Kuma KM-4 1230 70.0 0.022 1154 93 DATARED in KM 0.052 0.124 0.990
m69-m71 Shao C26H42KMnN 620.7 P-1 150 MoKa tube B AXS SMART APEX 19143 32.5 0.016 9907 376 SAINT 0.040 0.101 0.923
m72-m73 Wu C52H48Au2C 1622.5 Pnma 293 MoKa tube S SMART CCD 16736 25.1 0.097 5246 361 XPREP in SHEL 0.126 0.160 0.994
m74-m76 Lutz C6H14ClNO3 249.0 P-1 150 MoKa RA N KappaCCD 10000 27.6 0.050 2106 118 EVAL14 0.025 0.053 0.980
m77-m79 Santos C2H4N2NiS4 243.0 P21/c 100 MoKa KappaCCD 4294 25.0 0.045 1355 82 HKL DENZO and SCALEP 0.094 0.999
m80-m82 Laifa C36H19Fe4O 978.1 P21/n 293 MoKa tube N KappaCCD 28122 25.0 0.090 6888 496 DENZO and SCA 0.111 0.055 0.986
m83-m84 Urs C32H52O12Z 720.0 I41/a 293 MoKa tube B SMART CCD 19762 27.5 0.122 2111 106 SAINT 0.102 0.985
m85-m86 Jones C42H48Ru2 754.9 P21/c 178 MoKa tube Nicolet R3 11146 25.0 0.020 5984 407 XDISK 0.037 0.071 0.998
m87-m90 Francis C18H28I2N2 1009.1 C2/c 293 MoKa tube Philips PW1100 4484 30.0 0.021 4326 255 MolEN 0.054 0.061 0.998
m91-m94 Zhu C10H17Cl4N 414.5 P212121 173 MoKa tube B SMART 1K CCD 7460 25.5 0.025 3197 213 SAINT 0.033 0.063 0.999
o106-o107 Wang C16H13ClO2 272.7 P21/n 213 MoKa tube S SMART CCD 7752 28.3 0.126 3133 183 SAINT and SAD 0.122 0.168 0.972
o108-o110 Alagar C5H8NO6 178.1 P21/n 293 MoKa tube R AFC-5R 2321 30.1 0.050 2171 111 TEXSAN for Wi 0.118 0.193 0.997
o111-o113 Krishnamoor C19H20Cl2O 351.3 P21/c 298 MoKa RA EN CAD-4 7004 25.3 0.027 6670 423 MolEN 0.072 0.146 1.000
o114-o116 Chen C27H35NO4 437.6 P21 298 MoKa tube B SMART 1000 CCD 5557 28.4 0.056 3701 290 SAINT and XPR 0.108 0.124 0.912
o117-o118 Jones C18H26O7S 386.5 P21 143 MoKa tube Stoe DIF4 4605 27.5 0.018 4154 240 REDU4 0.043 0.100 0.997
o119-o120 Jones C16H30Si2 278.6 P-1 178 MoKa tube Nicolet R3 2355 27.5 0.015 2162 87 XDISK 0.064 0.115 0.995
o121-o123 Kooijman C23H29NO2 351.5 P21 150 MoKa RA N KappaCCD 37857 25.4 0.096 3787 469 DENZO 0.092 0.156 0.989
o124-o126 Yamin C13H11N3O3 289.3 P21/c 299 MoKa tube B SMART APEX CCD 7854 27.5 0.018 3065 181 SAINT 0.057 0.141 0.990
o127-o128 Dale C15H20N2O8 356.3 P21/c 150 MoKa tube B SMART 1000 CCD 8644 25.0 0.056 3064 240 SAINT 0.120 0.134 0.999
o129-o131 Guzei C30H29O5P 500.5 P21 100 MoKa tube B CCD-1000 5397 24.5 0.064 3050 325 SAINT 0.084 0.165 0.902
o132-o134 Paz C12H19N3O6 301.3 P21/c 180 MoKa tube N KappaCCD 21624 25.1 0.041 5304 423 HKL DENZO and 0.098 0.222 0.992
o135-o137 Gao C24H22N2O3 386.4 P21/n 293 MoKa tube B SMART CCD 7838 25.0 0.047 3399 263 SAINT 0.100 0.123 1.000
o138-o140 Ravishankar C19H15BrO3 371.2 Pna21 203 MoKa tube S SMART CCD 9099 28.3 0.129 3381 210 SAINT 0.136 0.169 0.990
o141-o142 Bendheif C10H28N2O1 398.3 P21/n 293 MoKa tube N KappaCCD 12190 26.4 0.065 3629 335 DENZO and SCA 0.043 0.100 0.945
o143-o144 Benelbaghda C19H18Cl1N 339.8 P-1 293 MoKa tube N KappaCCD 22942 26.4 0.033 6155 439 DENZO and SCA 0.052 0.114 0.904
o145-o147 Tomura C8H4N2O2S5 320.4 Pna21 296 CuKa tube EN CAD4 1303 74.2 0.000 1303 154 teXsan 0.151 0.174 1.001
o148-o150 Crouse C7H10Cl1N3 235.8 I4(1)/a 293 MoKa tube B Smart APEX CCD 12702 28.3 0.023 2545 135 SAINT 0.045 0.096 0.970
o151-o152 Yamin C14H12N2OS 256.3 P21/c 293 MoKa tube B SMART APEX CCD 8234 27.6 0.017 2917 163 SAINT 0.056 0.125 0.990
o153-o154 Jasinski C12H10F3NO 257.2 P-1 296 MoKa tube R AFC-6S 3292 30.0 0.061 3126 182 TEXSAN 0.260 0.168 0.947
o155-o157 Batsanov C16H16N2O4 428.6 C2/c 120 MoKa tube SMART 1K CCD 6260 27.5 0.022 2096 150 SAINT 0.031 0.079 0.997
o158-o160 Doboszewski C9H16O5 204.2 P21 293 MoKa tube S P4 1315 27.6 0.019 1211 131 P4 Software 0.049 0.081 0.998
o161-o163 Karadayi C15H9F6NO 333.2 P21/a 180 MoKa tube S P4 9212 25.2 0.068 2508 264 SHELXTL 0.121 0.191 0.995
o164-o166 Doriguetto C31H48O3 468.7 C2 100 MoKa tube N KappaCCD 4283 25.1 0.049 2486 315 HKL DENZO and SCALEP 0.159 0.983
o167-o168 Jones C35H23Cl3N 577.9 P212121 178 MoKa tube Nicolet R3 3618 27.5 0.000 3618 361 XDISK 0.135 0.222 0.997
o169-o170 Jones C20H12N2 280.3 P-1 178 MoKa tube Nicolet R3 3368 25.0 0.016 2539 199 XDISK 0.057 0.111 0.998
o171-o173 Sawatzki C8H16N2O 156.2 P212121 200 CuKa tube EN CAD-4 3164 60.0 0.073 1315 107 XCAD4 0.032 0.073 0.999
o174-o176 He C26H16CuN4 512.0 P-1 293 MoKa tube B SMART CCD 3490 28.3 0.035 2504 192 SHELXTL 0.063 0.096 0.902
o177-o179 Govind C22H18Br2N 534.3 P-1 293 MoKa tube EN CA-D4 7786 25.0 0.053 7411 559 XCAD4 0.200 0.135 1.000
o180-o182 Cherouana C5H9N5O6S1 267.2 P21/c 293 MoKa tube N KappaCCD 6875 26.4 0.033 1821 161 DENZO and SCA 0.037 0.081 0.918
o183-o185 Zhang C42H54N4O1 774.9 C2 296 MoKa tube EN CAD-4 4178 26.0 0.045 2094 268 XCAD4 0.059 0.130 1.000
o186-o187 Jones C24H36 324.5 P21/n 143 MoKa tube Stoe Stadi-4 7622 25.0 0.025 7330 455 REDU4 0.107 0.165 0.995
o188-o189 Jones C16H14O3 254.3 P21/c 178 MoKa tube Nicolet R3 3018 27.5 0.020 2857 172 XDISK 0.090 0.133 0.988
o190-o192 Sluka C14H22F2N4 426.3 P21/c 120 MoKa tube Kuma KM-4 CCDr 9769 25.0 0.046 3200 249 Xcalibur 0.064 0.142 0.989
o193-o194 Vasiliev C3H8N4O2 132.1 P21/n 293 CuKa tube Kuma KM-4 1325 69.9 0.034 1168 102 DATARED in KM 0.040 0.106 0.990
o195-o197 Gordon C6H23N12O7 406.3 P21/n 293 MoKa tube B SMART1000 CCD 13097 27.5 0.024 4053 259 SMART 0.058 0.102 0.998
o198-o199 Lynch C21H25NO3 339.4 P21/c 150 MoKa BN FR591 B-N KappaCCD 8778 25.0 0.129 2934 247 DENZO and COL 0.182 0.223 0.932
o200-o202 Bhaskaran C28H28N6O 464.6 P-1 293 CuKa tube EN CAD-4 5192 71.9 0.100 4789 319 CAD-4 Softwar 0.287 0.196 1.000
o203-o205 Rajakannan C24H34O6 418.5 C2 293 MoKa tube S SMART CCD 4350 29.4 0.072 1651 136 SAINT 0.082 0.181 0.906
o206-o208 Rajagopal C5H8Cl3NO4 252.5 P21/n 105 MoKa tube B SMART 12338 28.3 0.018 2442 119 SAINT-NT 0.047 0.104 0.992
o209-o211 Alagar C13H15NO6 281.3 P21/n 123 MoKa tube B SMART CCD 13028 26.4 0.043 2704 183 SAINT 0.058 0.146 0.998
o212-o214 Ferrence C16H22N2O3 290.4 P212121 293 MoKa EN CAD-4 3414 25.8 0.057 1792 195 XCAD4 0.097 0.999
o215-o217 Usman C11H16Cl2N 344.5 P-1 293 MoKa tube S SMART CCD 3955 27.0 0.013 2865 172 SAINT 0.023 0.058 0.958
o218-o219 Jones C18H14N2O 274.3 P21/n 178 MoKa tube Nicolet R3 2567 25.0 0.023 2409 190 XDISK 0.142 0.219 0.997
o220-o221 Jones C20H12N2 280.3 C2/c 178 MoKa tube Nicolet R3 2674 25.0 0.026 2596 200 XDISK 0.058 0.099 0.998
o222-o224 Lynch C21H21ClN4 396.9 P21/c 120 MoKa BN FR591 B N KappaCCD 14972 25.0 0.105 3422 252 DENZO and COL 0.067 0.124 0.997
o225-o226 Thamotharan C9H8BrN3O 254.1 P21/c 160 MoKa N FR590 t N KappaCCD 22923 30.0 0.087 2710 133 DENZO-SMN and 0.051 0.092 0.997
o227-o229 Kaafarani C32H21NO2 451.5 P21/c 1730.885 synchrotr Proteum 300 19213 29.5 0.095 3438 316 SAINT 0.082 0.156 0.999
o230-o231 Armas C18H21N1O4 315.4 C2/c 293 CuKa S P4 4C 7611 0.030 2962 212 XSCANS 0.071 0.219
o232-o233 Mizuguchi C22H16N2O2 340.4 P21/c 223 MoKa R AFC-7R 2107 27.5 0.013 1747 118 TEXSAN 0.126 0.997
o234-o236 Mohamed C13H10ClNO 247.7 P21/n 293 CuKa tube Enraf-Nnius CAD-4 2300 69.9 0.044 2093 162 MolEN 0.041 0.097 1.000
o237-o239 Jeyabharath C29H19Cl2N 500.4 P-1 293 CuKa tube EN CAD-4 9478 72.0 0.047 9032 629 XCAD-4 0.070 0.139 0.966
o240-o241 Jeyabharath C30H22ClNO 479.9 P21/n 293 CuKa tube EN CAD-4 5076 72.4 0.028 4874 317 XCAD-4 0.127 0.148 0.947
o242-o243 Lynch C15H23N2O4 327.4 C2/c 150 MoKa BN FR591 B-N KappaCCD 12347 27.5 0.113 3916 226 DENZO and COL 0.200 0.300 0.989
o244-o246 Bomfim C12H7BrN2O 291.1 Pnma 120 MoKa EN FR591 EN KappaCCD 15272 27.5 0.052 1376 103 DENZO and COL 0.032 0.077 0.998
o247-o249 Li C34H23.5Cl 732.8 P-1 293 MoKa tube B SMART CCD 8673 25.0 0.034 5928 421 SAINT and SHE 0.148 0.186 0.970
o250-o252 Low C21H23N3O 333.4 P21/c 120 MoKa tube N KappaCCD 9156 25.0 0.056 3762 230 DENZO-SMN 0.080 0.135 0.920
o253-o254 Scheibitz C4H12BrN 154.1 P21/c 173 MoKa tube Stoe IPDS-II 2C 5255 27.8 0.063 1675 78 X-AREA 0.057 0.072 0.975
o255-o257 Mariyatra C26H22IOP 508.3 Pbca 120 MoKa tube B SMART 1K CCD 29262 28.3 0.030 5663 350 SAINT-NT 0.033 0.057 0.996
E59 Part 3
i25-i27 Johnston H2Li2O5Se 174.9 P21 293 MoKa tube B SMART1000 CCD 2324 32.5 0.027 1153 75 SAINT 0.030 0.073 0.993
i28-i30 Barrier Mo7.62O14P 1096.0 Aba2 293 MoKa tube N KappaCCD 11744 37.9 0.056 2540 108 DENZO and SCA 0.049 0.093 0.991
i31-i32 Wickleder ClHoO3Se 327.3 Pnma 293 MoKa tube IPDS I 4891 30.0 0.061 688 35 X-RED 0.027 0.053 1.000
i33-i35 Ouarsal H8Mg1Na1O1 308.3 Pbca 295 MoKa tube Oxford Instrument 10838 30.0 0.058 1760 168 JANA2000 0.027 0.066 1.000
i36-i39 Kolitsch O5Sc2Ti 217.8 Cmcm 293 MoKa tube N KappaCCD 728 32.5 0.008 435 28 HKL DENZO and 0.017 0.048 1.000
i40-i42 Weil B4HgO7 355.8 Pbca 293 MoKa tube EN CAD-4 11114 30.0 0.072 1516 110 HELENA implem 0.033 0.056 0.999
i43-i46 Kolitsch Bi3.041Mo2 1055.8 C2/c 293 MoKa tube N KappaCCD 3569 32.6 0.023 1833 86 HKL DENZO and 0.022 0.052 0.997
m95-m96 Yamin C22H20Fe2N 424.1 P21/c 293 MoKa tube B SMART APEX CCD 5939 27.5 0.051 2066 119 SAINT 0.093 0.136 1.000
m97-m98 Spek C32H35ClNP 606.5 P212121 150 MoKa RA EN TurboCAD-4 7202 27.4 0.020 6433 330 HELENA 0.025 0.053 1.000
m99-m101 Rabe C50H61Cl2N 955.3 C2/c 173 MoKa tube B APEX CCD 10236 26.5 0.026 4686 267 SAINT and SHE 0.053 0.105 0.957
m102-m104 Yan C28H44Mo8N 1740.2 P21/c 293 MoKa tube SMART CCD 7194 25.1 0.024 4280 335 SMART and SAI 0.050 0.104 0.987
m105-m107 Jones C13H23F3N2 450.8 P212121 180 MoKa tube N KappaCCD 11560 27.5 0.063 3927 208 HKL DENZO an 0.048 0.069 0.996
m108-m110 Laifa C21H13Fe4O 839.9 P-1 293 MoKa tube EN CAD-4 6499 26.3 0.019 6179 426 XCAD4 0.048 0.097 0.999
m111-m113 Jones C45H44Cl4F 1084.4 P21/n 180 MoKa tube N KappaCCD 32010 27.5 0.048 10110 496 HKL DENZO an 0.102 0.234 0.994
m114-m115 Nordell C46H32N8O1 1084.9 P21/c 293 MoKa tube B SMART APEX CCD 32100 26.4 0.034 8443 622 SAINT-Plus-NT 0.035 0.062 0.998
m116-m118 Lee C8H48N24O2 2162.9 R-3 298 MoKa tube Stoe STADI4 1629 27.5 0.000 1629 96 X-RED 0.093 0.106 1.000
m119-m121 Nather C12H48Mn2N 1108.8 P2/n 293 MoKa tube Stoe IPDS 29806 27.0 0.055 6991 301 IPDS Program 0.034 0.075 0.927
m122-m124 Bian C4H12CdCl2 271.5 P21/c 293 MoKa tube B SMART 1K CCD 3239 25.0 0.052 1484 82 SHELXTL 0.065 0.125 1.000
m125-m127 Chojnacki C19H32HgO5 601.2 I41/a 200 MoKa tube Stoe IPDS 21819 25.9 0.052 9345 511 X-RED 0.068 0.057 0.951
m128-m130 Wang C50H42Cu1N 870.4 C2/c 293 MoKa tube B SMART 1000 CCD 8399 25.0 0.085 3765 362 SAINT 0.129 0.096 0.999
m131-m133 Usman C7H14AgF3N 371.1 Cmca 293 MoKa tube S SMART CCD 7471 28.3 0.026 1633 110 SAINT 0.075 0.163 0.995
m134-m136 Sun C56H64Cl4F 1721.3 P21/n 110 MoKa tube B SMART Apex CCD 32788 28.3 0.033 7907 403 SAINT 0.040 0.099 0.999
m137-m139 Tombul C32H32Li4N 564.4 I41/a 160 MoKa tube B SMART 1K CCD 9983 26.0 0.040 1918 102 SAINT 0.051 0.102 0.937
o258-o260 Mills C14H22N4S2 310.5 C2/c 150 MoKa RA N KappaCCD 16592 27.5 0.092 3686 185 HKL2000 0.056 0.101 0.994
o261-o262 Selvanayaga C17H21NO3 287.4 P21/n 293 MoKa tube S SMART CCD 10433 28.3 0.029 3912 191 SAINT 0.064 0.127 0.996
o263-o265 Carey C36H34O6 562.6 P-1 160 CuKa tube Stoe-S 5605 67.7 0.083 5182 397 local program 0.086 0.132 0.967
o266-o268 Yogavel C17H14O3 266.3 P212121 293 CuKa EN FR590 EN CAD4 1645 74.9 0.000 1645 183 XCAD4 0.054 0.171 0.998
o269-o271 Gunatilleke C26H32Cl4N 826.4 P-1 100 MoKa tube N KappaCCD 16863 29.5 0.030 2656 236 DENZO and SCA 0.074 0.111 0.970
o272-o274 Li C18H15Cl2N 376.2 P-1 293 MoKa tube B SMART CCD 6966 25.0 0.019 3028 230 SAINT 0.045 0.090 0.978
o275-o276 Ma C12H11N5O6 353.3 P-1 293 MoKa tube B CCD 4129 26.7 0.027 2912 217 SAINT 0.101 0.117 0.961
o277-o279 Rajagopal C7H10Cl3NO 278.5 P31 105 MoKa tube B SMART 13374 35.0 0.021 4363 177 SAINT 0.027 0.069 0.999
o280-o282 Sundar C20H19NO3 321.4 P21/c 293 CuKa tube N KappaCCD 35501 69.9 0.051 2994 218 HKL DENZO and 0.057 0.137 0.987
o283-o284 Renaudet C28H24O9 504.5 P212121 293 MoKa tube EN CAD-4 4024 30.0 0.000 3389 334 TEXSAN 0.065 0.035 0.950
o285-o287 Deng C11H13N2O2 268.3 P-1 298 MoKa tube B CCD 2621 25.0 0.017 2208 154 SHELXTL 0.047 0.118 0.993
o288-o289 Doriguetto C10H11N3O4 237.2 P-1 120 MoKa tube N KappaCCD 6740 25.0 0.104 1753 154 HKL DENZO and SCALEP 0.159 0.954
o290-o292 Ravishankar C22H18O2 314.4 P21/n 293 MoKa tube S SMART CCD 9778 28.3 0.114 4107 290 SAINT 0.130 0.143 0.981
o293-o295 Ravishankar C22H18O2 314.4 P21/c 183 MoKa tube S SMART CCD 8283 26.5 0.119 3288 272 SAINT 0.133 0.196 0.988
o296-o298 Low C20H25BrN4 481.4 P-1 120 MoKa tube N KappaCCD 13949 25.0 0.050 4648 274 DENZO-SMN 0.049 0.088 0.965
o299-o301 Andrade C25H34O6 430.5 P212121 293 CuKa tube EN MACH-3 6910 72.6 0.068 2624 284 HELENA 0.073 0.154 0.969
o302-o303 Luck C16H14N2S 266.4 Pca21 293 MoKa EN TurboCAD-4 1274 25.0 0.019 1214 172 XCAD4 0.099 1.000
o304-o305 Zarychta C8H15N3O3S 233.3 P-1 293 MoKa tube Xcalibur 4395 28.0 0.056 2712 145 CrysAlisRED 0.061 0.131 0.861
o306-o307 Vrabel C23H28N2O9 476.5 P21/c 293 MoKa tube Syntex P2~1~ 5519 27.6 0.000 5519 313 XP21 0.242 0.083 0.998
o308-o309 Deschamps C12H15NO3S 285.4 C2/c 296 CuKa RA 8381 67.1 0.049 2328 168 SAINT and XPR 0.049 0.120 0.948
o310-o311 Zhou C12H23N3 209.3 P21/n 153 MoKa tube S CCD 5024 25.5 0.031 2317 151 SAINT 0.086 0.144 0.992
o312-o313 Liu C6H6N4S2 198.3 P21/n 150 MoKa tube B SMART CCD 2404 27.5 0.036 881 55 SAINT 0.037 0.084 0.989
o314-o315 Crundwell C16H10N2S2 294.4 P21/c 293 MoKa tube B SMART P3/512CCD 10027 26.0 0.049 2617 181 SHELXTL 0.084 0.122 1.000
o316-o318 Rajagopal C2HCl3O2 163.4 P21/c 105 MoKa tube B SMART 10831 37.5 0.022 2969 68 SAINT 0.037 0.081 0.977
o319-o320 Fischer C10H10O4 194.2 P21 100 MoKa tube B N KappaCCD 7099 27.4 0.037 2162 253 HKL SCALEPACK 0.036 0.074 0.993
o321-o323 Armas C20H19N1O4 369.4 P21/n 293 CuKa S P4 4C 4884 0.047 3411 239 XSCANS 0.062 0.148
o324-o325 Jones C22H26N2 318.5 P21/c 178 MoKa tube Nicolet R3 6491 25.0 0.028 3204 225 XDISK 0.073 0.118 0.998
o326-o327 Batsanov C12H7IN2O4 498.3 P21/c 120 MoKa tube B SMART 1K CCD 12107 29.2 0.069 4254 208 SAINT 0.087 0.119 0.978
o328-o329 Fallon C30H26N2O8 606.7 P21/c 123 MoKa tube KappaCCD 19123 27.5 0.054 3375 193 HKL DENZO and 0.063 0.105 0.952
o330-o331 Li C19H14Cl2N 421.3 Pbca 293 MoKa tube B SMART CCD 13516 25.0 0.057 3335 245 SAINT 0.097 0.110 0.995
o332-o333 Zarychta C16H15NO3 269.3 P-1 90 MoKa tube Xcalibur 5193 28.0 0.028 3174 226 CrysAlisRED 0.055 0.100 0.844
o334-o336 Low C16H17N3O5 331.3 P21 120 MoKa tube N KappaCCD 6197 27.5 0.071 1883 219 DENZO-SMN 0.084 0.094 0.988
o337-o339 Zou C27H33N5O9 571.6 P-1 293 MoKa tube B SMART CCD 7300 25.0 0.039 4991 378 SAINT 0.159 0.153 0.993
o340-o341 Yamin C14H11BrN2 335.2 P21/c 273 MoKa tube B SMART APEX CCD 7554 27.5 0.026 3081 172 SAINT 0.050 0.091 0.990
o342-o343 Shan C13H11N3O3 257.3 Pc 298 MoKa tube R AFC-7S 1328 26.0 0.016 1190 172 TEXSAN 0.073 0.091 1.000
o344-o346 Kresge C7H10O3 142.2 Cc 150 MoKa tube N KappaCCD 8426 27.5 0.039 3220 400 DENZO-SMN 0.066 0.118 0.993
o347-o349 Burrow C22H28O7 404.4 P212121 150 MoKa tube N KappaCCD 10310 25.0 0.150 2039 269 DENZO-SMN 0.087 0.146 0.999
o350-o352 Burrow C25H33Cl3O 567.9 P212121 100 MoKa tube N KappaCCD 8481 20.1 0.132 2410 332 DENZO-SMN 0.089 0.161 0.977
o353-o355 Ompraba C14H17N3O 243.3 P21/n 293 MoKa tube S SMART CCD 9076 28.3 0.040 3291 167 SAINT 0.106 0.168 0.948
o356-o357 Liu C10H14N4S2 254.4 P21/c 288 MoKa tube S P4 1339 25.0 0.029 1097 74 SHELXTL 0.059 0.104 1.000
o358-o359 Yamin C16H14N4O2 514.7 P21/n 273 MoKa tube B SMART APEX CCD 7458 27.5 0.034 2862 155 SAINT 0.084 0.135
o360-o362 Reddy C10H10N2O4 222.2 P21/c 298 CuKa tube R AFC-7S 4615? 0.082 3111 289 TEXSAN 0.090 0.095?
o363-o365 Aree C16H10O7 314.2 P21/a 295 MoKa tube SMART CCD 9429 30.5 0.018 3781 248 SHELXTL and S 0.059 0.125 0.942
o366-o368 Li C11H20N2O4 276.4 P-1 298 MoKa tube B SMART 1K CCD 4811 27.0 0.020 2188 163 SAINT-Plus ? 0.057 27.500
o369-o371 Jones C16H20BrNO 370.2 P-1 173 MoKa tube S P4 6090 25.0 0.046 3046 207 XSCANS 0.068 0.050 0.990
o372-o373 Duggan C32H28B2O8 562.2 P212121 123 MoKa tube N KappaCCD 33146 27.5 0.128 3926 379 HKL DENZO and 0.128 0.097 0.988
o374-o375 Qi C12H9BrN2O 277.1 P-1 294 MoKa tube B SMART CCD 3649 27.5 0.018 2508 145 SHELXTL-NT 0.083 0.080 0.987
o376-o377 Vrabel C19H24N2O4 408.5 P-1 293 MoKa tube Oxford Xcalibur C 6596 29.1 0.032 5344 247 CrysAlisRED 0.140 0.125 0.892
o378-o380 Vembu C13H10N2O7 338.3 Pbca 100 MoKa tube B SMART CCD 31334 27.6 0.025 3170 248 SAINT-NT 0.034 0.087 0.997
o381-o383 Aree C17H18O7 334.3 P21 295 MoKa tube B SMART CCD 5907 30.5 0.022 2412 289 SHELXTL and S 0.049 0.095 0.951
o384-o386 Armas C20H18Br1N 448.3 P212121 293 CuKa S P4 4C 5061 0.038 4714 493 XSCANS 0.050 0.132
o387-o389 Lindner C40H82O31 1059.1 P21 211 MoKa tube Stoe IPDS-II 36831 27.1 0.077 5703 684 X-RED 0.066 0.076 0.993
E59 Part 4
i47-i49 Werner F4KPr 256.0 Pnma 293 MoKa tube EN CAD-4 4028 30.0 0.048 617 38 HELENA implem 0.024 0.048 1.000
i50-i52 Tahiri H8K2O16P4Z 531.5 P-1 292 MoKa tube B SMART APEX CCD 4313 31.6 0.081 2154 114 SAINT 0.093 0.093 0.906
i53-i54 Burger C4I2O4Rh2 571.7 P21/n 153 MoKa tube Stoe IPDS 6101 26.1 0.089 1980 110 INTEGRATE in 0.058 0.141 0.987
i55-i58 Kolitsch Li3Mo3O12S 545.6 Pnma 293 MoKa tube N KappaCCD 2635 30.1 0.011 1477 99 HKL DENZO and 0.027 0.058 0.997
i59-i61 Bali Ba2CoO7Si2 501.8 P-421m 293 MoKa tube B SMART CCD 1383 30.5 0.026 575 34 SAINT 0.028 0.064 0.975
i62-i64 Johnston H5ClCoO5Se 258.4 Pnma 293 MoKa tube B SMART1000 CCD 11031 32.5 0.025 2199 80 SAINT 0.026 0.062 0.998
i65-i67 Zid K2Mo1O9P2 380.1 C2/c 293 MoKa tube EN CAD-4 1919 27.0 0.017 1843 128 XCAD4 0.053 0.077 0.991
m140-m141 Usman C32H28AgF4 714.5 C2/c 293 MoKa tube S SMART CCD 9317 28.3 0.022 3699 237 SAINT 0.056 0.114 0.984
m142-m144 Zhang C42H40Cl12 1592.0 P-1 293 MoKa tube B SMART CCD 7133 23.3 0.014 4163 360 SAINT 0.034 0.078 0.992
m145-m147 Friedrich C17H16FeO4 441.2 P212121 100 MoKa tube Oxford Xcalibur 2 15516 31.7 0.053 5254 209 CrysAlisRED 0.026 0.062 0.958
m148-m151 Vinogradova C16H57.333 1074.9 P42/n 150 MoKa tube B SMART CCD 63965 26.4 0.077 3803 397 Xtal3.5 0.129 0.087 0.990
m152-m154 Wang C16H14CdN4 502.8 P21/n 293 MoKa tube B SMART CCD 6782 25.0 0.034 3372 244 SAINT 0.042 0.997
m155-m156 Yoshikawa C24H24Cl2F 776.6 P21/n 296 MoKa R RAXIS-RAPID IP 32401 0.068 6274 343 TEXSAN 0.126
m157-m159 Chen C32H20Br2F 921.0 P-1 293 MoKa tube S CCD 4372 25.0 0.016 2907 214 SAINT 0.037 0.065 0.986
m160-m161 Barnes C24H31KN4O 670.6 P-1 298 MoKa tube EN CAD-4 3065 25.5 0.023 2827 206 XCAD4 0.094 0.107 1.000
m162-m164 Flemstrom C12H20Cl14 1296.2 C2/c 293 MoKa tube Stoe IPDS 8558 23.9 0.049 2368 170 IPDS Software 0.038 0.062 0.930
m165-m167 Golobic C4.28H4.56 293.6 P21/c 293 MoKa N KappaCCD 12602 27.5 0.026 2019 156 DENZO-SMN 0.029 0.018 0.988
m168-m170 Jones C26H44Cl2N 770.3 P21/n 143 MoKa tube Stoe STADI-4 3862 27.5 0.017 3416 211 REDU4 0.031 0.068 0.996
m171-m173 Jones C36H54Cl6N 1201.1 P21/c 143 MoKa tube Stoe STADI-4 8250 25.0 0.035 4031 292 REDU4 0.039 0.069 0.998
m174-m175 Chee C35H28F3N3 714.3 P21/n 158 MoKa tube B SMART 39984 26.4 0.051 6320 414 SAINT 0.042 0.062 0.978
m176-m178 Zhou C74H68Br4C 2136.4 P21/c 293 MoKa tube B SMART 23308 25.0 0.007 8072 460 SAINT 0.037 0.157 0.999
m179-m182 Paz C3H18N2O15 537.0 Pnma 180 MoKa tube N KappaCCD 12781 27.5 0.064 1789 131 HKL DENZO and 0.035 0.073 0.998
m183-m184 Rickard C6H16Cl4N2 349.2 Pna21 203 MoKa tube S SMART 13246 28.1 0.027 3059 123 SAINT 0.020 0.045 0.955
m185-m187 Zhang C8H26F6GeN 451.7 Cccm 293 MoKa tube B CCD 1847 25.0 0.032 739 57 SHELXTL 0.054 0.119 0.996
m188-m189 Mohamed C15H30N3Ni 503.5 C2/c 173 MoKa tube Stoe IPDS-II 2C 16440 29.7 0.037 3232 115 X-AREA 0.030 0.061 0.993
m190-m191 Mohamed C12H26N2S4 445.3 C2/c 293 MoKa tube Stoe IPDS-II 2C 41948 25.8 0.048 5755 258 X-AREA 0.046 0.052 0.990
m192-m194 Jones C58H63Mg2N 1060.7 P21/n 133 MoKa tube B SMART 1000 CCD 57401 25.0 0.087 9872 684 SAINT 0.091 0.105 0.999
m195-m196 Wu C58H56Cu2F 1350.0 C2/c 293 MoKa tube S SMART 1K CCD 8897 25.0 0.025 5273 368 XPREP in SHEL 0.094 0.169 0.985
m197-m198 Held C2H18FeN2O 382.2 P-1 293 MoKa N MACH3 4830 34.2 0.040 2660 125 MolEN 0.027 0.063 0.997
m199-m201 Li C10H20N6Ni 475.2 P-1 293 MoKa tube S SMART CCD 2494 25.0 0.064 1521 148 SAINT 0.074 0.174 0.982
m202-m204 Chee C50H54F6O1 1182.3 P-1 168 MoKa tube B AXS 16310 26.5 0.022 5179 400 SAINT 0.025 0.056 0.970
m205-m206 Chee C60H50F6N4 1274.4 P-1 168 MoKa tube B AXS 17712 26.4 0.040 5484 360 SAINT 0.034 0.077 0.970
m207-m209 Delgado C25H18Co2O 1067.7 P-1 180 MoKa Stoe IPDS 18747 26.2 0.031 6954 439 XRED 0.094 0.905
m210-m211 Wu C38H32F6N2 978.5 P21/n 293 MoKa tube S SMART CCD 10524 25.1 0.024 6291 442 XPREP 0.072 0.110 0.989
m212-m214 Wang C14H8CuK2N 672.1 P21/c 293 MoKa tube S SMART CCD 3306 25.0 0.025 1929 169 SAINT and SHELXTL 0.106 0.987
m215-m217 Chu C10H12Cu2N 431.4 P21/n 293 MoKa tube B SMART APEX CCD 5902 30.0 0.030 2166 109 SAINT 0.055 0.073 0.997
m218-m219 Tolhurst C113H100Cl 2152.8 P-1 1230.559 synchrotr SMART 6000 mounte109758 19.0 0.049 15139 1156 SAINT and XPR 0.116 0.243 0.870
o390-o392 Linden C30H26Br2N 606.4 P212121 173 MoKa Rigaku RA R AFC-5R 8236 27.6 0.047 6049 336 TEXSAN 0.141 0.106 0.994
o393-o394 Zou C16H12N2S4 360.5 P21/n 293 MoKa tube B SMART CCD 6363 25.0 0.037 2791 199 SAINT 0.075 0.094 1.000
o395-o396 Thiruvalluv C10H8O2 160.2 Pbca 293 MoKa EN CAD-4 1419 25.0 0.000 1419 109 MolEN 0.092 0.999
o397-o398 Shan C13H11NO4 245.2 Pca21 140 MoKa tube N KappaCCD 9868 27.5 0.050 2325 163 HKL DENZO and 0.039 0.085 0.992
o399-o400 Yamin C14H10BrCl 353.6 P21/n 293 MoKa tube B SMART APEX CCD 9216 27.5 0.022 3130 181 SAINT 0.054 0.098 0.990
o401-o402 Gouin C22H24N2 316.4 P21/c 150 MoKa N KappaCCD 17647 32.0 0.056 6050 217 HKL DENZO and 0.102 0.147 0.990
o403-o405 Xie C19H26O3 302.4 C2/c 296 MoKa tube R AFC-5S 3156 25.1 0.012 3098 204 PROCESS in TE 0.096 0.129 1.000
o406-o407 Xie C19H26O3 302.4 P21/c 296 MoKa tube R AFC-5S 3069 25.1 0.008 2971 204 PROCESS in TE 0.063 0.113 0.999
o408-o411 Lichtenthal C56H110O47 1599.6 P212121 173 MoKa tube Stoe IPDS 2 34217 28.3 0.118 9891 941 X-RED 0.178 0.255 0.994
o412-o414 Rybakov C11H10N2O3 218.2 P21/c 293 MoKa tube EN CAD-4 1939 26.0 0.010 1939 158 WinGX-98 0.069 0.119 1.000
o415-o416 Qi C21H19N3O2 345.4 C2/c 294 MoKa tube B CCD 5712 27.6 0.137 2084 120 SHELXTL-NT 0.199 0.181 0.980
o417-o419 Lu C18H29ClN6 444.9 P21/c 183 MoKa tube SMART 1K CCD 8201 24.8 0.074 3529 278 SAINT 0.119 0.097 0.952
o420-o422 Fukunaga C12H11NO5 249.2 P21/c 298 MoKa Rigaku RA R AFC-5R 4496 30.0 0.031 3252 208 TEXSAN for Wi 0.066 0.179 0.999
o423-o424 Wang C18H15N3 273.3 P21/c 296 MoKa tube S P4 2919 25.0 0.022 2448 199 SHELXTL 0.053 0.102 1.000
o425-o427 Emge C11H14BrNO 256.1 P21/n 100 MoKa tube B SMART APEX CCD 12893 28.3 0.028 2677 183 SAINT-Plus 0.028 0.056 1.000
o428-o429 Jeunesse C64H66O6P2 993.1 P21212 173 MoKa tube S R3 9442 27.5 0.022 6225 327 XSCANS 0.040 0.085 0.997
o430-o432 Wang C28H25N5O2 463.5 P21/c 293 MoKa tube B SMART 1000 CCD 10034 25.0 0.097 4285 324 SAINT 0.163 0.151 1.000
o433-o434 Chopra C10H12O4 196.2 P21/c 293 MoKa tube B SMART CCD 7814 27.7 0.017 2193 175 SAINT 0.050 0.109 0.933
o435-o437 Li C20H26N2O6 390.4 C2/c 294 MoKa tube S P4 2017 25.0 0.034 1771 130 SHELXTL 0.109 0.124 0.999
o438-o440 Ma C14H14N4O6 366.4 P-1 293 MoKa tube B SMART CCD 4849 26.4 0.034 3413 229 SAINT 0.121 0.119 0.987
o441-o442 Koman C13H10N4O8 350.3 P21/n 293 CuKa tube Syntex P2~1~ 3511 65.1 0.031 2212 231 XP21 0.064 0.110 0.898
o443-o444 Saraogi C14H12BrNO 290.2 P-1 293 MoKa tube B SMART CCD 5884 25.1 0.043 2133 154 SAINT 0.073 0.100 0.996
o445-o446 Breitung C11H18F3NO 269.3 P21/m 173 MoKa tube Stoe IPDS-II 2C 3390 25.2 0.041 1215 100 X-AREA 0.067 0.141 0.948
o447-o449 Kolev C2H8N4O3 136.1 P21/c 293 MoKa tube EN CAD-4 3408 29.9 0.029 1708 114 DATARED 0.063 0.115 0.902
o450-o452 Armas C16H11N1O4 313.3 P21/c 293 CuKa S P4 4C 3514 0.042 2535 203 XSCANS 0.098 0.167
o453-o454 Chen C18H16N2S4 388.6 P21/c 293 MoKa B SMART 5025 28.3 0.050 2020 141 SAINT 0.081 0.933
o455-o457 Jones C14H16N2 212.3 P212121 180 MoKa tube N KappaCCD 6085 25.0 0.056 1229 159 HKL DENZO and 0.039 0.082 0.994
o458-o460 Noland C4H4Br2N2 239.9 P-1 174 MoKa tube S SMART 6725 27.5 0.028 2962 147 SAINT 0.039 0.080 0.983
o461-o462 Krishnamoor C21H24O2 308.4 Pbca 293 CuKa tube EN CAD-4 3094 67.9 0.000 3094 212 MolEN 0.155 0.198 0.958
o463-o465 Kavitha C19H18Cl2O 349.2 Pbca 293 MoKa tube EN CAD-4 3164 25.3 0.041 3163 208 MolEN 0.079 0.140 0.992
o466-o468 Linehan C25H16OS2 396.5 P21/c 293 MoKa tube B SMART P3/512CCD 17124 28.4 0.041 4511 267 SAINT and SHE 0.082 0.132 0.911
o469-o471 Mizuguchi C28H28N2O6 488.5 P21/c 93 CuKa R R-AXIS RAPID IP 21098 67.8 0.060 4401 325 TEXSAN 0.126 0.992
o472-o473 Mizuguchi C30H32N2O6 516.6 P21/n 93 CuKa R R-AXIS RAPID IP 12159 68.3 0.051 2241 172 TEXSAN 0.107 0.932
o474-o475 Mizuguchi C30H28N2O6 512.6 P21/n 93 CuKa R R-AXIS RAPID IP 10974 68.1 0.043 2240 172 TEXSAN 0.075 0.992
o476-o477 Mohamed C12H8Br2 312.0 P21/n 173 MoKa tube STOE IPDS-II 2C 17434 25.3 0.078 3820 253 X-AREA 0.066 0.077 0.993
o478-o479 Lu C7H5Cl3N2O 271.5 Pbca 193 MoKa tube B SMART 1K CCD 7949 25.0 0.029 1837 137 SAINT 0.055 0.112 0.999
o480-o482 Kruger C11H28BrNO 270.3 P21/c 293 MoKa tube B SMART CCD 10404 28.3 0.060 3647 127 XPREP 0.110 0.123 0.990
o483-o484 Vaduvescu C37H26Cl2N 625.5 Pccn 150 MoKa tube N KappaCCD 21389 25.0 0.107 2639 215 DENZO-SMN 0.096 0.175 0.998
o485-o487 Fischer C10H10O4 194.2 P-1 100 MoKa tube N KappaCCD 14054 27.5 0.075 3445 253 EvalCCD 0.107 0.133 0.799
o488-o489 ozturk C17H13Br1N 385.2 P21/c 293 MoKa tube S SMART CCD 9585 28.3 0.041 3858 245 SAINT 0.120 0.107 0.980
o490-o492 Muir C9H11F1N2O 182.2 Pbca 100 MoKa N KappaCCD 6796 25.9 0.057 1797 124 HKL DENZO and SCALEP 0.116 0.991
o493-o494 Wu C19H29BrNO 430.3 P21/n 294 MoKa tube S SMART CCD 27403 27.5 0.061 9427 451 SHELXTL-NT 0.134 0.117 0.997
o495-o497 Moreno-Fuqu C24H22N4O6 462.5 Pbca 293 MoKa tube EN CAD-4 6757 30.4 0.026 3350 158 XCAD4 0.087 0.146 1.000
o498-o500 Li C25H29NO4 407.5 P212121 293 MoKa tube B SMART CCD 9147 25.0 0.049 3861 275 SAINT and SHE 0.110 0.106 1.000
o501-o502 Coles C14H22O6 286.3 Pna21 120 MoKa BN FR591 B-N KappaCCD 14735 0.061 1717 186 DENZO and COL 0.036 0.075 0.998
o503-o505 Vembu C13H11ClO3 282.7 P-1 100 MoKa tube B SMART CCD 4385 0.027 2227 207 SAINT-NT 0.049 0.096
o506-o508 Paz C30H47NO8 549.7 P1 180 MoKa tube N KappaCCD 26943 25.1 0.029 17008 1441 HKL DENZO and 0.057 0.113 0.988
o509-o510 Batsanov C20H19NO3 321.4 P21/c 150 MoKa tube SMART 1K CCD 17984 27.5 0.046 3880 294 SAINT 0.070 0.097 1.000
o511-o513 Wolska C13H9N3O2 239.2 P21/c 293 MoKa tube Kuma KM-4 CCD 6578 28.0 0.014 2608 176 CrysAlisRED 0.048 0.127 0.994
o514-o516 Ray C25H21N 335.4 C2/c 298 MoKa tube B SMART 1K CCD 12785 28.3 0.035 4539 236 SAINT 0.117 0.167 0.996
o517-o518 Low C24H24N6 396.5 P21/c 120 MoKa tube N KappaCCD 24082 25.0 0.093 4800 274 DENZO-SMN 0.093 0.138 0.998
o519-o521 Roa C13H15NOS 233.3 P212121 296 MoKa B P4 4962 28.7 0.019 3247 146 XSCANS 0.099 0.167 1.000
o522-o523 Jones C20H12N2 280.3 P21/n 178 MoKa tube Nicolet R3 4770 25.0 0.053 2542 199 XDISK 0.147 0.217 0.998
o524-o526 Arrieta C19H15NO2 289.3 Pca21 105 MoKa tube B SMART 14386 27.0 0.052 3044 259 SAINT 0.052 0.097 1.000
o527-o529 Shao C16H19N3O3 301.3 P-1 293 MoKa tube S P4 5698 25.0 0.023 5401 397 SHELXTL 0.090 0.178 1.000
o530-o532 Coruh C12H11ClN4 278.7 P-1 293 MoKa tube EN CAD-4 MACH3 2723 26.0 0.015 2503 174 XCAD4 0.099 0.121 1.000
o533-o534 Bolte C54H70Cl6O 1059.8 Pbca 173 MoKa tube S SMART CCD three 52500 25.0 0.050 10229 643 SAINT 0.135 0.297 0.997
o535-o537 Jones C44H32P2 622.6 P21 180 MoKa tube N KappaCCD 11117 25.1 0.043 5303 415 HKL DENZO and 0.059 0.088 0.991
o538-o539 Baker C15H24IN 345.3 P21/c 293 MoKa tube N KappaCCD 8952 25.1 0.047 2944 164 DENZO-SMN 0.072 0.099 0.984
o540-o541 Smith C6H10N2O3S 190.2 P21/n 296 MoKa Rigaku RA R AFC-7R 2631 29.6 0.041 2451 138 TEXSAN for Wi 0.155 0.174 0.970
o542-o544 Sun C16H11ClI3 693.4 P21/c 293 MoKa tube Siemems SMART CCD 5930 25.1 0.046 3492 226 SAINT 0.112 0.179 0.959
o545-o546 Mahjoub C16H28S6 412.8 P21/c 293 MoKa tube EN CAD4 3473 30.0 0.014 2261 109 teXsan 0.038 0.061 0.950
o547-o549 Dupont C13H8N2O3S 319.2 P21/n 293 CuKa tube Stoe-S AED 4C 2310 68.1 0.035 2146 173 REDU4 0.065 0.145 0.983
o550-o552 Fun C7H7N2O6 215.2 Cmc21 293 MoKa tube S SMART CCD 2626 0.072 485 74 SAINT 0.052 0.112
o553-o554 Chen C8H13NO3 171.2 Pna21 294 MoKa tube S SMART CCD 5793 27.6 0.069 2037 113 SHELXTL 0.129 0.088 0.996
o555-o557 Subramaniam C25H28N2O9 500.5 C2 168 MoKa tube B AXS CCD 15060 26.5 0.039 2493 329 SAINT 0.041 0.084 0.990
o558-o560 Guo C15H14O4 258.3 P21212 293 MoKa tube B SMART CCD 14655 28.3 0.056 3275 344 SAINT 0.093 0.148 0.932
o561-o563 Williams C12H14O2 190.2 Pbca 150 MoKa EN TurboCAD4 2431 25.0 0.037 1847 131 XCAD4 0.064 0.112 1.000
o564-o565 Beckmann C11H20N2O4 244.3 P-1 173 MoKa tube S P4 2719 27.5 0.016 2598 162 XSCANS 0.051 0.101 0.993
o566-o568 Beckmann C11H21ClN2 280.8 P21/c 143 MoKa tube Stoe STADI-4 3416 27.5 0.021 2977 175 REDU4 0.078 0.135 0.994
o569-o571 ozturk C20H22N2O 306.4 P21/c 294 MoKa tube N KappaCCD 30666 26.0 0.089 3326 274 EVALCCD 0.095 0.132 0.997
o572-o573 Yufit C16H24ClNO 393.8 P-1 120 MoKa tube B SMART-CCD 1K 11202 29.0 0.026 4763 331 SHELXTL 0.046 0.085 0.983
o574-o576 Bendjeddou C7H8Cl1N1O 237.6 P-1 223 MoKa tube KappaCCD 3143 25.0 0.034 1629 138 DENZO and SCA 0.040 0.140 0.871
o577-o578 Yu C15H15N5O9 409.3 P21/n 295 MoKa tube S P4 3305 25.0 0.020 3154 265 SHELXTL 0.093 0.142 1.000
o579-o580 Ma C9H10O3 166.2 P21/n 173 MoKa tube R/ADSC CCD 6942 0.9 0.039 1748 113 d*TREK 0.071 0.122 27.900
o581-o582 Zhang C9H7N3OS2 237.3 P21/c 293 MoKa tube B SMART CCD 2862 25.1 0.017 1822 137 SAINT 0.050 0.085 0.977
o583-o585 Stomberg C19H21ClO4 348.8 P-1 173 MoKa tube S SMART CCD 14932 31.5 0.022 5768 242 SAINT and SAD 0.047 0.113 0.983
o586-o588 Zhu C4H12N6O3 192.2 P-1 184 MoKa tube B SMART 1K CCD 1875 25.0 0.022 1559 155 SAINT 0.074 0.129 0.980
o589-o590 Gainsford C23H27IN2O 490.4 P21/c 1000.920 synchrotr Quantum4 CCD 2300 29.0 0.000 2300 262 DENZO 0.026 0.071 0.909
E59 Part 5
i68-i69 Tahiri H8K2MnO16P 521.1 Pnma 294 MoKa tube B SmartApex CCD 14628 28.3 0.079 1890 128 SAINT 0.057 0.063 0.997
i70-i71 Gorlov Cl4GaK 250.6 P21/n 297 MoKa tube N KappaCCD 4148 27.1 0.037 1537 55 DENZO and SCA 0.055 0.117 0.990
i72-i74 Lee Co2H32K2O4 1441.7 P-1 298 MoKa tube Stoe Stadi-4 4092 27.5 0.000 4092 262 X-RED 0.050 0.096 1.000
i75-i76 Smith MgO6PtSr3 578.3 R-3c 293 MoKa tube B SMART APEX CCD 2412 36.3 0.037 490 20 SAINT-Plus-NT 0.028 0.049 0.998
i77-i79 Brahim Ag1.49As3M 742.3 C2/c 293 MoKa tube EN CAD-4 1112 27.0 0.071 1067 97 MolEN 0.074 0.156 0.998
i80-i82 Boulay Li3O4Ta1 265.8 C2/c 293 MoKa R Rapid image pla 10260? 0.038 2422 74 RAPID-AUTO an 0.033 0.026?
m220-m222 Okabe C50H43Fe2N 1081.6 P-1 296 MoKa R AFC-5R 11146 27.5 0.054 10701 658 teXsan 0.174 1.000
m223-m224 Chen C32H46Fe2N 881.3 C2/c 293 MoKa tube B P4 6972 25.0 0.063 3488 208 SHELXTL 0.099 0.153 1.000
m225-m227 Clegg C63H47AlO4 895.0 P32 160 CuKa tube Stoe-S 4C 19969 65.0 0.042 19761 1838 local program 0.110 0.228 0.970
m228-m229 Li C17H10CuN4 397.8 P21/n 293 MoKa tube S SMART CCD 5179 25.0 0.024 2560 235 SAINT 0.106 0.991
m230-m231 Li C12H14CdN2 442.7 P212121 293 MoKa tube S SMART CCD 5071 25.1 0.046 2500 221 SAINT 0.109 0.995
m232-m233 Wei C54H50Ag2C 1265.5 P21/n 293 MoKa tube S SMART CCD 9485 25.0 0.060 4806 326 SAINT 0.135 0.131 0.994
m234-m235 Reck C34H52N2O2 714.4 P-1 293 MoKa tube EN CAD-4 6539 25.0 0.008 6517 397 PROCESS in Mo 0.043 0.101 0.991
m236-m238 Nockemann C32H72Hg4I 2556.3 P-1 293 MoKa tube Stoe IP System IP 37776 26.0 0.107 11615 434 X-RED 0.096 0.060 1.000
m239-m240 Rivard C12H36Cl12 1198.1 P21/c 150 MoKa tube N KappaCCD 11340 27.5 0.050 4422 169 DENZO-SMN 0.046 0.088 0.993
m241-m243 Diaz C17H24CuN1 524.0 P21/n 183 MoKa tube S SMART CCD 36079 33.0 0.040 8460 337 SAINT and SAD 0.056 0.121 0.924
m244-m246 Okabe C20H14N2O5 427.7 P21/c 296 MoKa R AFC-5R 4602 27.5 0.048 3985 253 TEXSAN 0.170 1.000
m247-m248 Okabe C20H20N2O8 481.8 P21/n 296 MoKa R AFC-5R 2598 27.5 0.026 2247 142 TEXSAN 0.129 1.000
m249-m251 Cai C12H16LaN3 517.2 C2/c 293 MoKa tube S SMART CCD 2844 25.0 0.034 1574 125 XPREP in SHEL 0.051 0.111 0.991
m252-m254 Peng C15H26CuFe 525.9 P-1 293 MoKa tube B SMART CCD 9026 30.0 0.017 6292 280 SAINT 0.054 0.091 0.971
m255-m256 Rabe C28H40LiO3 600.5 P21/n 150 MoKa tube CCD 15206 27.7 0.023 5717 298 SAINT 0.035 0.076 0.955
m257-m259 Wu C14H8ClCuN 409.2 Cc 293 MoKa RA R Mercury CCD 5925 27.5 0.042 2952 226 CrystalClear 0.056 0.115 0.995
m260-m262 Dong C8H18CoN7O 367.2 P21/n 293 MoKa tube B P4 3523 25.0 0.038 2635 200 XSCANS 0.065 0.100 0.988
m263-m265 Zhu C14H12Ag2C 562.9 C2/c 293 MoKa tube S SMART CCD 5101 28.3 0.031 2139 109 SAINT 0.094 0.130 0.979
m266-m267 Onoda C35H34CuF6 719.2 P21/n 296 MoKa tube R AFC-5R 7686 27.5 0.150 7302 425 TEXSAN 0.301 0.227 0.925
m268-m270 Vincendeau C14H14S2Se 452.2 P21/c 180 MoKa tube Stow IP System 26415 26.1 0.055 5732 449 IPDS Software 0.048 0.097 0.964
m271-m272 Li C29H24Cr1N 530.5 P21/n 298 MoKa tube B SMART CCD 8913 25.0 0.039 4362 334 SAINT 0.081 0.162 0.990
m273-m275 Chee C74H63AgF6 1480.7 P21/n 168 MoKa tube B SMART 85582 26.5 0.040 14277 842 SAINT 0.072 0.122 0.990
m276-m279 Park C190H138Cl 6168.3 P-1 150 MoKa tube N KappaCCD 71313 27.5 0.074 27876 1276 DENZO-SMN 0.088 0.196 0.990
m280-m282 Nather C12H44N8O2 762.3 P-1 293 MoKa tube EN CAD-4 4132 29.0 0.007 3858 138 Structure Det 0.020 0.054 0.998
m283-m285 Laifa C23H22Fe4O 936.0 P21/c 293 MoKa tube EN CAD-4 7804 26.0 0.006 6840 439 XCAD4 0.050 0.076 0.990
m286-m288 Pan C4H24CoN2O 447.3 P21/n 293 MoKa tube S SMART CCD 5044 25.1 0.026 2914 256 SAINT 0.071 0.112 0.979
m289-m290 Scholz C4H8AlBr3O 338.8 P21/m 100 MoKa tube Stoe IPDS-II 2C 4060 25.1 0.082 918 55 X-AREA 0.080 0.110 1.000
m291-m293 Onoda C70H70Cl14 1810.8 P-1 200 MoKa tube R R-AXIS-RAPID IP 9543 27.5 0.037 8029 455 TEXSAN 0.095 0.144 0.916
m294-m296 Li C16H30CoO2 601.3 P-1 293 MoKa tube S SMART CCD 3102 25.0 0.019 2076 203 SAINT (S 1994 0.041 0.095 0.969
m297-m299 Liu C48H42CoN6 1017.8 P-1 298 MoKa tube B SMART CCD 14499 27.6 0.035 9991 658 SAINT 0.099 0.135 0.960
m300-m302 Zhou C30H24Cl2N 726.2 C2/c 293 MoKa tube S SMART CCD 4475 25.0 0.033 2637 213 SAINT 0.082 0.142 0.986
m303-m305 Yao C15H24ClNR 419.0 P-1 294 MoKa tube B Apex CCD 9910 28.3 0.014 4582 181 SAINT-Plus 0.026 0.061 0.982
o591-o593 Yogavel C12H12O3 204.2 P-1 293 CuKa EN FR590 EN CAD-4 2091 74.9 0.000 2091 140 XCAD4 0.069 0.198 1.000
o594-o595 Lohr C48H26S2 666.9 C2 123 MoKa R RAXIS-IV 6879 27.0 0.022 2081 240 TEXSAN 0.094 0.994
o596-o598 Williams C28H28OP2 442.4 P-1 295 MoKa Rigaku RA R AFC-7R 3238 27.5 0.026 2752 145 TEXSAN for Wi 0.069 0.154 0.999
o599-o600 Liang C32H23N2O2 498.5 P212121 294 MoKa tube S CCD 17396 27.6 0.075 5805 334 SHELXTL 0.142 0.058 0.993
o601-o602 Cheng C6H8N4O2 168.2 P21/c 293 MoKa tube B SMART CCD 3540 25.0 0.037 1288 110 SAINT 0.042 0.102 0.995
o603-o605 Low C23H19ClN2 374.9 Cc 120 MoKa tube N KappaCCD 17924 25.0 0.095 7396 488 DENZO-SMN 0.108 0.201 0.988
o606-o607 Megzari C26H20N2 360.4 Pca21 173 MoKa tube Stoe IPDS II 2C 31816 29.5 0.072 5318 509 X-AREA 0.067 0.123 0.991
o608-o609 Yuan C17H21NO2 271.4 P212121 293 MoKa tube B SMART APEX CCD 7631 25.0 0.065 2605 186 SAINT 0.052 0.074 0.994
o610-o611 Li C16H15NO2 253.3 Pbca 293 MoKa tube S SMART CCD 13782 26.0 0.035 2709 221 SAINT 0.095 0.157 1.000
o612-o613 Usman C20H15NO2 301.3 P21/c 293 MoKa tube S SMART CCD 19495 28.3 0.021 7725 415 SAINT 0.071 0.125 0.993
o614-o615 Low C26H22N4O2 422.5 P-1 120 MoKa tube Kappa-CCD 13871 25.0 0.094 4524 294 DENZO-SMN 0.098 0.151 0.972
o616-o618 Aydin C17H13NO4S 327.4 P21/c 293 MoKa EN CAD-4 4283 26.3 0.002 2818 208 XCAD4 0.108 0.190 0.919
o619-o621 Jones C2HBr3O2 296.8 C2/c 133 MoKa tube B SMART 1000 CCD 9331 30.0 0.037 1823 68 SAINT 0.027 0.053 0.998
o622-o624 Aravindan C15H11N3S 265.3 Pbca 293 MoKa tube EN CAD-4 2197 25.0 0.015 2110 173 XCAD4 0.077 0.146 0.834
o625-o627 Nesterov C11H9N3O 199.2 P-1 297 MoKa tube S P3/PC 2065 25.1 0.066 1820 137 SHELXTL 0.092 0.183 0.978
o628-o629 Chan C14H14N2S3 306.5 P-1 293 MoKa tube B SMART APEX CCD 9682 27.5 0.016 3405 173 SAINT 0.043 0.113 0.990
o630-o631 Brown C8H8O4 168.1 P21/n 295 MoKa Rigaku RA R AFC-7R 2012 27.5 0.029 1784 110 TEXSAN for Wi 0.061 0.140 0.999
o632-o634 Jones C5H4Br3N 317.8 C2/m 133 MoKa tube B SMART 1000 CCD 7962 30.0 0.030 1308 58 SAINT 0.024 0.052 0.999
o635-o637 ozturk C19H15NO3 305.3 P212121 298 MoKa tube S P4 4236 28.0 0.037 2118 254 XSCANS 0.057 0.097 1.000
o638-o640 Florke C32H64O12 640.8 P212121 153 MoKa tube B SMART CCD 22975 27.1 0.108 4594 413 SAINT 0.218 0.085 0.997
o641-o642 Arslan C20H15ClN2 366.9 P-1 293 MoKa tube B P4 5122 27.5 0.016 4095 227 SHELXTL 0.066 0.122 0.998
o643-o645 Dakir C9H14N4 178.2 P21/n 293 MoKa tube N KappaCCD 18845 25.0 0.140 4910 361 DENZO and SCA 0.149 0.149 0.940
o646-o648 Ohba C81H87NO10 1234.6 P21 248 CuKa R AFC-7R 6683 65.0 0.081 5806 833 TEXSAN 0.172 0.990
o649-o651 Bendjeddou C5H9Cl2N5O 354.1 P-1 120 MoKa tube N KappaCCD 14891 33.1 0.030 4647 207 DENZO and SCA 0.053 0.105 0.989
o652-o653 Usman C21H14N2O4 358.3 I41cd 293 MoKa tube S SMART CCD 10396 28.3 0.019 1133 122 SAINT 0.035 0.092 0.999
o654-o656 Urban C15H12N2 220.3 P21/c 291 MoKa tube N KappaCCD 2169 26.0 0.000 2169 177 HKL DENZO and 0.070 0.140 0.998
o657-o658 Kedziorek C11H9NO 171.2 P212121 293 MoKa tube Oxford Excalibur 6381 27.1 0.134 1176 119 CrysAlis RED 0.184 0.157 0.997
o659-o661 Aravindan C22H28N2O3 368.5 P-1 293 MoKa tube S SMART CCD 7019 28.3 0.022 4804 260 SAINT 0.075 0.146 0.967
o662-o664 Yogavel C9H13ClN2O 248.7 P21/c 293 MoKa tube S SMART CCD 7777 28.3 0.039 2854 151 SAINT 0.082 0.153 0.960
o665-o666 Hulme C4H3F3O2 140.1 P21/c 190 MoKa N KappaCCD 4700 27.1 0.010 2429 187 DENZO/SCALEPA 0.050 0.100 0.983
o667-o669 Krishna C25H20O4 384.4 P21/n 293 CuKa tube EN CAD-4 3967 71.9 0.014 3783 263 XCAD4 0.073 0.153 0.938
o670-o671 Li C34.75H24C 848.6 P-1 293 MoKa tube B SMART CCD 10032 25.0 0.020 6787 467 SAINT and SHE 0.087 0.195 0.995
o672-o674 Sankaranara C19H18N2O4 338.4 P-1 293 MoKa tube S SMART CCD 5992 28.3 0.025 4109 228 SAINT 0.091 0.189 0.958
o675-o676 Li C18H12Cl3N 396.6 C2/c 293 MoKa tube B SMART CCD 8872 25.0 0.051 3078 226 SAINT 0.108 0.108 0.995
o677-o678 Li C21H23IN2O 494.4 P21/c 293 MoKa tube B SMART CCD 11395 26.4 0.040 4347 247 SAINT 0.076 0.104 0.995
o679-o680 Cui C25H23N2OP 398.4 P21/n 293 MoKa tube B SMART CCD 8613 25.0 0.062 3727 262 SAINT and SHE 0.106 0.120 0.999
o681-o682 Tai C16H16N4O2 296.3 P21/c 293 MoKa tube B SMART Apex CCD 7186 25.0 0.048 2621 202 SAINT 0.059 0.107 0.997
o683-o685 Simon C9H8N2O7 256.2 Fdd2 133 MoKa tube B SMART 1000 CCD 3941 30.0 0.028 773 83 SAINT 0.030 0.073 1.000
o686-o687 Simon C9H8N2O5 224.2 P21/c 133 MoKa tube B SMART 1000 CCD 10780 30.0 0.032 2707 146 SAINT 0.037 0.091 0.998
o688-o690 Simon C13H8N2O7 304.2 P21/c 133 MoKa tube B SMART 1000 CCD 9339 28.5 0.032 3286 199 SAINT 0.046 0.097 0.997
o691-o692 Simon C15H10N2O7 330.3 P21/c 133 MoKa tube B SMART 1000 CCD 26129 26.4 0.048 8781 649 SAINT 0.071 0.079 0.999
o693-o695 Stibrany C30H26N4 442.6 P21/c 294 MoKa tube B SMART CCD 16281 25.0 0.036 4179 411 SAINT 0.080 0.174 0.992
o696-o698 Seshadri C31H40ClN3 538.1 P21/n 293 MoKa tube S SMART CCD 19702 28.3 0.118 7195 348 SAINT 0.239 0.216 0.955
o699-o700 Henry C20H21ClO4 360.8 P-1 193 MoKa tube B SMART Apex CCD 6105 28.3 0.065 4225 230 SAINT-Plus 0.056 0.147 0.914
o701-o702 Kayal C11H16O2 180.2 P21/n 150 MoKa tube B SMART CCD 13507 25.0 0.031 3517 239 SAINT 0.063 0.100 1.000
o703-o705 Ganesh C23H17Cl2N 442.3 P-1 293 MoKa tube S SMART CCD 16575 28.3 0.038 9692 525 SAINT 0.065 0.121 0.956
o706-o707 Li C23H27NO4S 413.5 P212121 294 MoKa tube B CCD 14469 27.5 0.072 4879 266 SHELXTL-NT 0.131 0.091 0.994
o708-o710 Uno C14H28Br2 356.2 P21/n 296 CuKa R AFC-5R 2304 70.1 0.038 1563 74 CrystalStructure 0.099 0.994
o711-o712 Li C36H33N3O2 539.7 P-1 293 MoKa tube B SMART CCD 7663 25.0 0.030 5152 372 SAINT 0.125 0.181 0.994
o713-o715 Hazazi C17H14Cl2N 349.3 Pna21 293 MoKa tube N KappaCCD 23068 26.4 0.034 1666 201 DENZO and SCA 0.024 0.058 0.980
o716-o717 Li C35H24Cl6N 733.3 C2/c 293 MoKa tube B SMART CCD 27390 25.0 0.099 11983 829 SAINT and SHE 0.189 0.099 0.995
o718-o720 Rajakannan C25H20N2O5 460.5 P21/n 293 MoKa tube S SMART CCD 17151 28.4 0.074 5372 312 SAINT 0.086 0.118 0.941
o721-o722 Wang C29H19NO3 429.5 P-1 293 MoKa tube S SMART CCD 5771 26.0 0.016 4110 374 SAINT and SAD 0.050 0.117 0.969
o723-o725 Resende C9H8N2O2 176.2 Cc 120 MoKa N KappaCCD 2565 25.0 0.096 1436 143 HKL DENZO and SCALEP 0.131 0.996
o726-o727 Kalaitzis C3H9NO3S 139.2 P212121 295 MoKa Rigaku RA R AFC-7R 1011 27.5 0.052 820 74 TEXSAN 0.032 0.085 1.000
o728-o730 Barnes C10H16O5 216.2 P-1 100 MoKa tube B SMART APEX CCD 6332 31.0 0.013 3260 145 SAINT 0.038 0.109 0.971
o731-o733 Barnes C22H44N2O1 528.6 C2/c 150 MoKa EN FR591 EN KappaCCD 7946 27.5 0.070 2939 190 DENZO and COL 0.088 0.114 0.970
o734-o736 Twamley C8H18IN4OP 344.1 R32 213 MoKa tube Burker/S SMART 1K 14029 25.4 0.041 1324 73 SAINT-Plus 0.050 0.117 0.993
o737-o738 Hamzah C13H15NO4 249.3 Pbca 293 MoKa tube B SMART APEX CCD 15920 27.5 0.019 2859 163 SAINT 0.049 0.128 0.990
o739-o741 Shi C15H18N2O4 290.3 P-1 293 MoKa tube B SMART CCD 7713 25.1 0.035 5277 418 SAINT 0.151 0.168 0.986
E59 Part 6
i83-i85 Goriounova B3O6Tb 287.4 I2/a 293 MoKa N MACH3 5729 44.9 0.094 1602 48 MolEN 0.063 0.082 1.000
i86-i88 Boulay Cs3O14Ta5 1527.5 Pbam 295 MoKa tube R Rapid image pla 2269? 0.060 2269 117 Rapid-Auto 0.044 0.032?
i89-i91 Kuratieva H16MgO10P2 262.4 P42/nmc 295 MoKa tube EN CAD4 809 29.1 0.038 427 33 CD4CA0 0.068 0.048 1.000
i92-i94 Zarkouna Ce0.1133H4 146.0 P4/nnc 293 MoKa tube EN CAD-4 1679 26.9 0.011 880 84 XCAD4 0.026 0.068 1.000
m306-m307 Rajeswaran C27H18InN3 547.3 P-1 293 MoKa tube N KappaCCD 11360 26.8 0.112 4647 307 HKL DENZO and 0.106 0.150 0.982
m308-m309 Masui C26H42Cl4N 946.8 P-1 173 MoKa tube B SMART CCD 8007 23.3 0.017 5113 405 SAINT 0.031 0.066 0.987
m310-m312 Deng C6H8MnO8 263.1 P212121 298 MoKa tube B APEX 5277 28.2 0.037 1936 160 SAINT 0.094 0.950
m313-m314 Parvez C4H10Cl2S2 258.5 P21/n 170 MoKa tube R AFC-6S 1834 25.0 0.066 1706 84 TEXSAN 0.088 0.117 0.995
m315-m316 Osawa C24H24FeN2 492.3 P21/n 123 MoKa R/MSC Mercury CCD 8886 27.5 0.039 2506 151 TEXSAN 0.069 0.984
m317-m318 Qin C77H72Ag3C 1948.5 P21/n 293 MoKa tube S SMART CCD 25151 25.0 0.047 14088 807 XPREP 0.122 0.210 0.983
m319-m321 Shi C17H34LiN3 315.5 P212121 183 MoKa oil seale S SMART CCD 8455 25.0 0.122 3588 215 SAINT 0.166 0.104 1.000
m322-m323 Matthews C58.50H54N 1266.9 P21/n 120 MoKa N RA N KappaCCD 40261 25.0 0.111 10247 711 COLLECT and D 0.098 0.135 0.964
m324-m326 Yang C28H30N4O1 647.9 P-1 293 MoKa RA R R-AXIS-RAPID 13836 27.5 0.021 6500 436 PROCESS-AUTO 0.036 0.082 0.989
m327-m329 Sundar C18H16Cr2N 476.3 P21/c 293 MoKa EN CAD-4 3447 25.0 0.034 3283 262 XCAD4 0.093 0.162 1.000
m330-m332 Liu C18H20N4Ni 447.1 P-1 298 MoKa tube R R-AXIS RAPID 4252 27.5 0.015 2036 133 CrystalStruct 0.031 0.074 0.990
m333-m335 He C26H20CoN4 543.4 C2/c 293 MoKa tube B CCD 7278 28.2 0.029 2830 210 SHELXTL 0.043 0.087 0.946
m336-m338 Akashi C24H40Na4O 1157.0 P-1 93 MoKa R R-AXIS-IV 8541 26.5 0.018 4233 358 CrystalStructure 0.091 0.917
m339-m341 Shi C22H43LiN4 398.6 P21 178 MoKa oil B CCD 10666 25.0 0.043 8386 527 SAINT 0.103 0.066 0.997
m342-m344 Zhang C12H10MnN2 333.2 C2/c 293 MoKa tube EN CAD-4 1103 25.0 0.017 1051 116 XCAD4 0.046 0.093 0.996
m345-m347 Lee C3H32CoMo6 1277.0 P-1 298 MoKa tube Stoe Stadi-4 3588 27.5 0.000 3588 229 X-RED 0.035 0.084 0.998
m348-m349 Awang C18H34N2S4 525.4 Pnma 293 MoKa tube B SMART APEX CCD 15359 27.6 0.029 2795 118 SAINT 0.038 0.081 0.990
m350-m352 Checinska C20H33Cl2N 733.4 C2/c 293 MoKa tube Kuma KM4 CCD 29455 25.0 0.099 4909 333 CrysAlisRED 0.052 0.089 0.998
m353-m355 Shao C18H16N3Nd 546.6 P21/c 293 MoKa tube EN CAD-4 3656 25.0 0.025 3441 323 XCAD4 0.044 0.074 0.999
m356-m358 Zhou C12H16CdN2 428.7 C2/m 293 MoKa tube S SMART CCD 1341 25.0 0.037 733 89 XPREP 0.095 0.983
m359-m360 Kucera C36H30Cl2M 651.8 Fdd2 90 MoKa tube B SMART 1000 21340 30.0 0.020 4774 196 SAINT 0.024 0.061 0.996
m361-m363 Liu C36H38N12O 816.2 P-1 293 MoKa tube S P4 7751 25.0 0.022 6479 509 XSCANS 0.080 0.089 0.998
m364-m366 Maxcy C60H56I10N 2979.9 P-1 293 MoKa tube SMART 1000 18436 24.7 0.084 6618 403 SAINT-Plus 0.050 0.092 0.996
m367-m369 Fu C8H33N8NiS 737.7 P-1 293 MoKa RA R Mercury CCD 8993 27.5 0.051 4908 199 CrystalClear 0.092 0.088 0.977
m370-m372 Evans C28H48Cl2N 903.1 P21/c 293 CuKa tube EN CAD-4 10879 66.9 0.051 6878 404 XCAD4 0.058 0.130 0.997
m373-m375 Doran C4H12N2O9S 502.2 C2/m 150 MoKa EN KappaCCD 2501 27.5 0.030 1240 95 DENZO/SCALEPACK 0.048 1.000
m376-m377 Englert C28H66P4Pd 739.5 233 MoKa EN CAD-4 4955 26.0 0.019 3617 163 PROCESS MolEN 0.048 0.134 0.997
m378-m380 Engelke C18H64Mn2N 1334.2 P21/n 293 MoKa tube Philips PW1100 7248 30.0 0.016 6518 214 REDU4 0.037 0.092 0.954
m381-m383 Billing C8H12Br3NP 569.1 P212121 293 MoKa B CCD 9328 28.3 0.062 3268 119 XPREP 0.065 0.995
m384-m386 Healy C54H45CuF6 995.3 P-1 295 MoKa Rigaku RA R AFC-7R 9918 25.0 0.042 8479 587 TEXSAN for Wi 0.088 0.163 0.998
m387-m389 Usman C30H34Cl2N 736.2 P21 293 MoKa tube S SMART CCD 10219 28.4 0.078 5925 407 SAINT 0.074 0.199 0.978
m390-m392 Wu C4H9NNiO6 225.8 P21ca 298 MoKa tube B SMART 4084 28.3 0.035 1613 124 SAINT 0.055 0.105 0.950
m393-m395 Chen C9H9NNiO5 269.9 Pnma 293 MoKa tube S SMART CCD 3021 25.0 0.075 950 89 XPREP/SAINT 0.091 0.138 0.991
o742-o744 Rajagopal C9H13NO10 295.2 P-1 293 MoKa tube EN CAD-4 2451 25.0 0.006 2250 198 CAD-4 Softwar 0.043 0.113 1.000
o745-o746 Kobayashi C11H10N2S2 234.3 P21/c 93 MoKa R R-AXIS RAPID IP 12265 30.0 0.034 2969 136 TEXSAN 0.101 0.994
o747-o749 ozcan C5H10O5S2 214.3 P-1 293 MoKa tube S P4 5527 30.0 0.032 5125 298 SHELXTL 0.042 0.103 1.000
o750-o752 Ocak C18H14Cl2N 389.2 P-1 293 MoKa tube B SMART CCD 4127 24.8 0.027 2730 235 SAINT 0.095 0.133 0.907
o753-o755 Baddeley C47H78O18 931.1 P21 150 MoKa EN FR591 N KappaCCD 45444 26.4 0.072 5812 586 DENZO and COL 0.094 0.234 0.997
o756-o758 Shi C22H20O8 412.4 P212121 293 MoKa R R-AXIS RAPID 4509 27.5 0.015 2610 272 TEXSAN 0.112 0.997
o759-o761 Ganguly C8H11BO4 182.0 P21/c 296 MoKa tube R AFC-5S 1745 25.1 0.007 1621 127 PROCESS in TE 0.053 0.101 1.000
o762-o764 Knight C11H10Br1N 300.2 P21/n 293 MoKa tube Mercury AFC-8S 11515 26.4 0.029 2437 145 CrystalClear 0.089 0.996
o765-o766 Baranowska C18H29NS 291.5 Pca21 200 MoKa tube Oxford KM-4 3593 26.4 0.000 3593 373 DATAPROC 0.132 0.144 0.968
o767-o768 Waller C15H10O2 222.2 P212121 150 MoKa tube B CCD 14562 28.3 0.023 3010 307 SAINT-Plus 0.042 0.108 0.990
o769-o770 Harrison CH8N3O3P 141.1 P21 293 MoKa tube B SMART1000 CCD 3144 32.5 0.015 1836 73 SAINT 0.032 0.076 0.996
o771-o772 Huang C23H32O9 452.5 P65 293 MoKa tube S SMART/CCD 19275 25.0 0.063 2119 280 SHELXS97 0.066 0.153 0.996
o773-o775 Usman C10H12OS2 212.3 Pbca 293 MoKa tube S SMART CCD 10961 28.3 0.034 2524 166 SAINT 0.077 0.137 0.995
o776-o779 Vembu C16H13NO3S 299.3 P-1 100 MoKa tube B Apex CCD 5712 25.0 0.033 3053 242 SAINT 0.054 0.128 0.920
o780-o782 Akkurt C18H18N2O 278.3 P21/c 294 MoKa tube N KappaCCD 9152 26.0 0.072 2938 191 EVALCCD 0.095 0.128 0.996
o783-o785 Parvez C11H14O4S2 274.3 P21/a 170 MoKa tube R AFC-6S 2249 25.1 0.042 2128 156 TEXSAN 0.151 0.134 1.000
o786-o788 Akkurt C25H32Cl2N 519.5 P-1 293 MoKa S SMART CCD 8119 28.3 0.026 6112 316 SAINT 0.066 0.154 0.930
o789-o791 Loughlin C16H20O5S 324.4 P-1 295 MoKa Rigaku RA R AFC-7R 4163 27.5 0.052 3537 200 TEXSAN for Wi 0.069 0.130 0.998
o792-o793 Lee C13H16N4O6 324.3 P21/c 298 MoKa tube AFC-7R 2966 25.0 0.019 1718 209 TEXSAN ? 0.048 1.030
o794-o796 Li C24H19ClN2 402.9 C2/c 293 MoKa tube SMART CCD 9301 26.4 0.039 4039 262 SAINT 0.123 0.131 0.991
o797-o798 Li C41H30Cl7N 860.8 P-1 293 MoKa tube B SMART CCD 10516 25.0 0.039 7038 504 SAINT and SHE 0.149 0.196 0.988
o799-o801 Lalibert&ea C29H28O4 440.5 I-4 220 CuKa Tube B AXS SMART 2K/Pl 3443 70.0 0.059 643 76 SAINT 0.051 0.141 0.997
o802-o803 Abourichaa C10H10N2O 174.2 P-1 173 MoKa tube Stoe IPDS II 2C 5318 25.0 0.025 1483 122 X-AREA 0.038 0.098 0.989
o804-o805 Isik C15H13FN4O 284.3 P21/c 293 MoKa tube B SMART CCD 7084 28.1 0.052 2992 198 SAINT 0.165 0.089 0.910
o806-o807 Aravindan C16H14O4 270.3 P-1 293 MoKa tube S SMART CCD 4829 28.3 0.064 3172 182 SAINT 0.166 0.240 0.951
o808-o809 Krishna C19H22O3 298.4 P212121 293 MoKa tube S SMART CCD 11019 28.3 0.034 2247 199 SAINT 0.050 0.114 0.997
o810-o811 Yusof C15H13N3O2 299.3 P21/c 273 MoKa tube B SMART APEX CCD 7907 27.5 0.043 3097 190 SAINT 0.097 0.133 0.960
o812-o813 Liu C10H10N4O4 314.3 P21/c 298 MoKa tube R R-AXIS-RAPID 3650 27.5 0.095 1359 91 CrystalStruct 0.090 0.137 0.990
o814-o816 Jian C25H18ClN3 411.9 P21/c 293 MoKa tube B P4 10228 26.0 0.045 3982 343 XSCANS 0.040 0.092 0.985
o817-o819 Zhang C10H12N2O2 224.3 P21/c 293 MoKa tube EN CAD-4 3712 25.0 0.091 1908 136 MolEN 0.056 0.138 0.999
o820-o822 Franca C17H13NO5 311.3 P-1 120 MoKa KappaCCD 11153 25.0 0.079 2424 260 HKL DENZO and SCALEP 0.121 0.998
o823-o824 Velde C22H22O2 318.4 P21/c 293 MoKa tube EN CAD-4 6278 32.0 0.083 3053 153 XCAD4 0.149 0.131 1.000
o825-o827 Padilla-Mar C14H16N2O6 308.3 C2/c 100 MoKa tube B SMART 5869 27.5 0.032 1607 133 SAINT 0.063 0.124 0.981
o828-o829 Yusof C11H12N2O3 252.3 P-1 273 MoKa tube B SMART APEX CCD 7220 27.5 0.017 2818 155 SAINT 0.053 0.123 0.985
o830-o832 Vembu C14H14O4S 278.3 P21/c 100 MoKa tube B SMART CCD 10615 27.7 0.042 2956 228 SAINT 0.065 0.128 0.984
o833-o835 Kaynak C11H14Cl3N 282.6 Pbca 295 MoKa EN CAD-4 5032 26.3 0.029 2597 145 XCAD4 0.124 0.997
o836-o837 Dale C15H18O6 294.3 P65 150 MoKa tube B SMART 1000 CCD 19450 26.0 0.038 3515 194 SAINT 0.080 0.122 0.948
o838-o840 Shan C10H12N4O4 252.2 P21/c 298 MoKa tube R R-AXIS RAPID 11248 27.5 0.037 2820 163 CrystalStruct 0.103 0.159 1.000
o841-o842 Blake C9H13NO5 215.2 P-1 150 MoKa tube Stoe Stadi-4 4C 2066 25.0 0.022 1580 140 REDU4 0.060 0.119 0.864
o843-o844 Deng C12Cl10S2 562.7 C2/c 298 MoKa tube EN CAD-4 3538 26.0 0.039 1774 109 XCAD4 0.045 0.099 1.000
o845-o847 Fleischer C8H14O2S2 206.3 P21/c 187 CuKa EN CAD-4 1126 73.8 0.169 1067 59 CORINC 0.060 0.134 1.000
o848-o850 Baddeley C32H46O19 734.7 P41212 150 MoKa N KappaCCD 50356 25.7 0.132 2206 281 DENZO and COL 0.103 0.155 1.000
o851-o853 Karadayi C16H11F6NO 363.3 P21/a 180 MoKa tube S P4 17689 25.0 0.044 2591 255 SHELXTL 0.096 0.195 0.983
o854-o856 Palusiak C18H19NO4 313.3 P21/c 293 CuKa tube R AFC-5S 2927 67.5 0.000 2927 208 TEXSAN 0.103 0.101 0.973
o857-o859 Alagar C7H13NO4 175.2 C2/c 293 MoKa tube EN CAD-4 2600 25.0 0.100 1524 111 CAD-4 Softwar 0.065 0.154 0.999
o860-o861 Mariusz C11H9NO 171.2 C2/c 293 MoKa tube Oxford Excalibur 5481 26.4 0.066 1803 121 CrysAlis RED 0.167 0.149 0.992
o862-o864 Holmes C5H6Br2N2 253.9 Cmca 293 MoKa RA R AFC-7 750 25.0 0.000 750 56 TEXSAN 0.060 0.116 1.000
o865-o867 Wang C30H18N4O6 530.5 P1 293 MoKa tube S SMART CCD 4222 27.5 0.017 3405 434 SMART 0.049 0.092 0.983
o868-o869 Cui C48H54Hg2I 1657.7 P21/n 298 MoKa tube B SMART CCD 11685 26.4 0.041 5142 271 SAINT and SHE 0.038 0.076 0.989
o870-o872 Shi C11H14ClN2 336.8 P-1 293 MoKa tube B SMART CCD 4506 26.4 0.020 3050 176 SAINT 0.064 0.112 0.982
o873-o874 Haghiri C9H8N2 144.2 P-1 173 MoKa tube Stoe IPDS II 2C 12794 25.2 0.059 5573 398 X-AREA 0.088 0.092 0.986
o875-o877 Krishna C19H17NO5S 371.4 P-1 293 MoKa tube S SMART CCD 6104 28.3 0.025 4175 236 SAINT 0.070 0.149 0.971
o878-o880 Rajagopal C8H15NO6 221.2 P1 293 CuKa tube EN CAD-4 2223 72.0 0.045 2003 272 CAD-4 Softwar 0.048 0.117 0.963
o881-o882 ozturk C29H27NO7 501.5 P-1 293 MoKa tube S SMART CCD 5384 27.3 0.000 5384 322 SAINT 0.137 0.257 0.838
o883-o885 Buyukgungor C14H12N2O2 240.3 P21/a 293 MoKa tube Stoe IPDS-II 12031 29.5 0.036 3434 212 X-RED 0.057 0.088 1.000
o886-o888 Ittyachan C6H20N4O10 370.2 P212121 293 CuKa tube EN CAD-4 1567 67.9 0.000 1567 216 CAD-4 Softwar 0.044 0.132 0.998
o889-o890 Ma C15H25O3.5 261.4 P21 293 MoKa tube B SMART CCD 8011 26.0 0.013 3127 335 SAINT 0.046 0.134 0.996
o891-o893 McLean C23H22O1 314.4 P-1 170 MoKa tube B CCD 20884 25.0 0.036 6224 438 SAINT 0.079 0.128 0.998
o894-o896 Thamotharan C20H16N2O4 348.4 P21 160 MoKa N FR590 t N KappaCCD 1752 25.0 0.078 1752 237 DENZO-SMN and 0.060 0.120 0.995
o897-o898 Beaudry C18H22ClNO 303.8 P21 148 MoKa tube SMART 1K CCD 7199 0.057 3143 378 SAINT 0.061 0.054
o899-o900 Kus C13H11Br3 407.0 P21/c 133 MoKa tube B SMART 1000 CCD 23006 30.0 0.092 3737 145 SAINT 0.052 0.094 0.999
o901-o902 George C25H20N2O 364.4 Pna21 293 MoKa tube EN CAD-4 4948 27.4 0.000 4296 253 Xtal3.5 0.104 0.133 1.000
E59 Part 7
i95-i97 Weil B2Cd2O5 326.4 P-1 293 MoKa EN CAD-4 5166 39.9 0.018 2584 83 HELENA implem 0.023 0.056 0.995
i98-i100 Held H16O20S3Y2 610.1 C12/c1 293 MoKa N MACH3 2498 30.4 0.034 2424 147 MolEN 0.094 0.095 0.996
i101-i102 Kabbour Gd3Nb1O4S3 724.8 Pn21a 293 MoKa tube N KappaCCD 18460 35.0 0.054 3130 102 HKL DENZO and 0.037 0.061 0.998
i103-i104 Assoud Se3Yb2 583.0 Fddd 298 MoKa tube B SMART APEX CCD 5337 35.0 0.049 1179 26 SAINT 0.046 0.074 0.983
i105-i106 Bramsen H13Cl3CuO1 471.0 P3221 180 MoKa tube B SMART 1000 CCD 7204 26.4 0.050 1610 118 SAINT 0.059 0.111 0.997
m396-m398 Burrow C18H23CoN6 494.6 Pca21 293 MoKa B SMART 12629 28.1 0.103 5124 269 SAINT 0.150 0.139 0.983
m399-m401 Caiazzo C43H41Cl2N 805.7 P21 150 MoKa tube N KappaCCD 21972 25.1 0.082 12013 883 DENZO-SMN 0.079 0.118 0.993
m402-m404 Reynolds C3H7Br2NO2 456.1 P21/c 82 MoKa tube B-S SMART APEX 7447 25.0 0.034 1423 84 SAINT-Plus 0.020 0.042 0.998
m405-m407 Tong C10H14CoN8 337.2 C2/m 293 MoKa RA R Mercury CCD 2432 27.6 0.019 878 76 CrystalClear 0.030 0.087 0.950
m408-m410 Sakai C6H12N6O8P 491.3 P21/c 296 MoKa tube B SMART APEX CCD 2782 23.3 0.033 911 97 SAINT 0.023 0.034 0.999
m411-m413 Sakai C28H28Cl8N 1608.6 P-1 296 MoKa tube B SMART APEX CCD 9820 23.3 0.088 5638 455 SAINT 0.151 0.117 0.966
m414-m415 Awang C26H29NS2S 538.3 P-1 273 MoKa tube B SMART APEX CCD 15537 27.6 0.020 5658 271 SAINT 0.026 0.070 0.970
m416-m418 Li C13H12Ag1F 441.2 P21/c 293 MoKa tube S SMART CCD 21114 27.6 0.067 7176 415 SAINT 0.126 0.076 0.996
m419-m420 Gao C48H48F6N8 1206.8 P21/n 293 MoKa tube S SMART CCD 15139 25.1 0.048 8405 604 XPREP 0.134 0.199 0.985
m421-m424 Lee C24H104Co3 2167.3 P-1 298 MoKa tube Stoe Stadi-4 8466 27.5 0.000 8466 484 X-RED 0.066 0.108 0.998
m425-m426 Bremner C6H14Cl4Co 314.9 P21/c 120 MoKa tube N KappaCCD 9112 27.5 0.057 2654 119 COLLECT 0.040 0.078 0.995
m427-m428 Srivastava C8H24Cl2O4 484.5 Pccn 120 MoKa tube KappaCCD 25051 33.2 0.085 6724 180 DENZO and SCA 0.116 0.088 0.992
m429-m430 Chen C15.5H12Cl 745.7 P-1 293 MoKa tube S SMART CCD 11706 25.1 0.032 7840 550 XPREP 0.083 0.161 0.990
m431-m433 Diz C46H70O10P 1249.2 P21/c 153 MoKa tube Stoe & Cie IPDS 38794 25.9 0.057 10053 586 INTEGRATE in 0.070 0.045 0.939
m434-m435 Fassler C28H32Cl2I 690.7 P-1 123 MoKa tube SMART CCD 13236 24.8 0.038 5843 613 SAINT 0.063 0.046 0.910
m436-m437 Wang C12H21FeN6 449.4 P21/c 293 MoKa tube SMART CCD 7394 25.1 0.055 3864 232 SAINT 0.146 0.971
m438-m440 Usman C10H13Cu1N 290.8 C2/c 293 MoKa tube S SMART CCD 7657 28.3 0.080 2718 163 SAINT 0.090 0.123 0.991
m441-m442 Bian C10H28CuN4 363.9 Pbca 293 MoKa tube CCD 5693 25.0 0.026 1341 105 B SHELXTL 0.042 0.075 1.000
m443-m445 Sakai C10H32N4O9 774.6 P-1 296 MoKa tube B SMART APEX CCD 10729 27.6 0.053 4964 245 SAINT 0.089 0.092 0.992
m446-m448 Stuart C5H16N2O11 582.4 P-1 150 MoKa EN Kappa CCD 5594 27.5 0.020 2640 191 Denzo/Scalepack 0.054 0.992
m449-m451 Sun C2H10MoN2O 382.2 C2/c 293 MoKa RA R Weissenberg IP 1167 27.5 0.000 1167 79 TEXSAN 0.023 0.057 0.998
m452-m453 Ng C32H28N10O 906.0 C2/c 298 MoKa tube EN CAD-4 3829 26.0 0.021 3679 278 XCAD4 0.131 0.152 1.000
m454-m455 Yang C18H12N2Ni 379.0 C2/m 298 MoKa tube EN CAD-4 1790 26.0 0.038 1728 128 XCAD4 0.081 0.135 1.000
m456-m458 Long C18H36N4Na 776.4 P21/n 298 MoKa tube B APEX 7204 25.0 0.054 2485 232 SAINT 0.082 0.151 0.970
m459-m461 Sakai C20H24N8O8 699.6 P21/n 296 MoKa tube B SMART APEX CCD 15077 28.2 0.098 5573 327 SAINT 0.047 0.083 0.914
m462-m463 Chaggar C26H23Cl2F 532.2 P21/c 150 MoKa tube B CCD 15046 25.0 0.027 4348 308 SAINT 0.038 0.083 0.995
m464-m466 Correia C16H22N4O6 431.8 P21/c 293 MoKa tube EN CAD-4 1930 26.0 0.015 1827 137 HELENA 0.045 0.071 0.999
m467-m469 Bremner C4H18Cl4Co 443.0 P21/n 293 MoKa tube B SMART1000 CCD 7802 32.5 0.019 2914 98 SAINT 0.043 0.068 0.993
m470-m472 Li C17H18N4O8 471.7 P-1 293 MoKa tube S CCD 4875 25.1 0.040 3303 303 SAINT 0.166 0.983
m473-m475 Tao C14H18CdN2 486.8 C2/c 298 MoKa tube B AXS 9529 28.2 0.024 3750 247 SAINT 0.031 0.056 0.930
m476-m477 Zhang C22H16N6O1 589.8 P-1 298 MoKa tube B AXS 1K CCD 3777 28.3 0.034 2623 186 SAINT 0.080 0.106 0.910
m478-m480 Ma C14H26MnO2 633.4 P-1 293 MoKa tube S P4 3086 26.0 0.022 2384 194 XSCANS 0.039 0.089 0.997
m481-m482 Ma C14H30CoO2 673.4 P-1 293 MoKa tube S P4 3436 26.0 0.028 2603 209 XSCANS 0.049 0.118 0.998
m483-m484 Ma C14H30NiO2 673.2 P-1 293 MoKa tube S P4 3424 26.0 0.026 2599 208 XSCANS 0.046 0.101 0.998
m485-m486 Ma C14H26CuO2 642.0 P-1 293 MoKa tube S P4 3134 26.0 0.017 2413 193 XSCANS 0.036 0.093 0.998
m487-m488 Ma C14H30O22S 679.9 P-1 293 MoKa tube S P4 3445 26.0 0.020 2615 209 XSCANS 0.043 0.088 0.997
m489-m490 Reck C18H36N2O4 538.1 P-421c 293 MoKa tube EN CAD-4 2940 25.0 0.042 1695 133 PROCESS in Mo 0.034 0.093 1.000
m491-m493 Hu C24.50H35. 845.4 C2/c 293 MoKa tube B SMART APEX CCD 19353 26.0 0.042 7082 460 SAINT 0.058 0.118 0.991
m494-m496 Wu C54H60Cl2N 1177.4 P41212 293 MoKa tube S P4 8048 26.0 0.011 5296 348 TEXSAN 0.050 0.159 0.977
m497-m499 Krinsky C47H86Cl2M 864.0 P-1 150 MoKa tube B SMART 1K CCD 6241 49.5 0.063 2734 250 SAINT 0.060 0.054 0.930
m500-m501 Schormann C9H26Cl2N2 351.9 P21/c 140 MoKa RA R R-AXIS-IIc 11409 25.4 0.027 6025 267 DENZO and SCA 0.045 0.085 0.948
m502-m503 Olmstead C29H37Cl2F 598.4 P212121 91 MoKa tube B SMART 1000 27291 31.5 0.023 9258 348 SAINT 0.033 0.075 0.966
m504-m506 Zhang C82H96Cl4C 2643.9 P-1 293 MoKa tube B SMART CCD 13013 25.0 0.040 8911 749 SMART 0.112 0.159 0.994
m507-m509 Yang C18H20N2Ni 451.1 P21 298 MoKa tube EN CAD-4 3070 30.0 0.059 2936 262 XCAD4 0.091 0.153 1.000
m510-m511 Evans C12H10Ni2O 303.6 P-1 115 MoKa KappaCCD 84232 30.0 0.071 6276 307 HKL Denzo and 0.027 0.065 1.000
m512-m514 Sakai C32H30Cl4N 1091.5 P21/n 296 MoKa tube B SMART APEX CCD 25018 28.3 0.080 9347 511 SAINT 0.062 0.126 0.926
m515-m517 Sakai C26H24Cl3N 915.9 P-1 296 MoKa tube B SMART APEX CCD 13736 28.3 0.067 6948 423 SAINT 0.037 0.089 0.906
m518-m520 Sakai C10H13Cl2N 473.2 P21/c 293 MoKa tube B SMART APEX CCD 8387 28.3 0.061 3188 163 SAINT 0.073 0.085 0.928
m521-m523 Wu C4H22N2Na2 382.2 Pna21 293 MoKa tube B SMART CCD 5700 25.0 0.025 2203 236 SHELXTL 0.030 0.064 1.000
m524-m526 Alagar C48H37O7PU 994.8 P21/c 293 MoKa tube EN CAD-4 7464 25.0 0.023 7221 515 CAD-4 Softwar 0.070 0.084 0.999
m527-m529 Liu C20H11ClN5 543.7 P21/c 293 MoKa tube S CCD 12114 26.1 0.183 4443 280 SAINT 0.134 0.199 0.991
m530-m531 Ng C12H14CoN8 361.2 C2/m 298 MoKa tube N KappaCCD 6996 28.5 0.033 949 68 DENZO SCALEPA 0.032 0.082 0.980
m532-m535 Sakai C24H48N16O 1789.1 C2/c 296 MoKa tube B SMART APEX CCD 20325 28.3 0.101 5608 298 SAINT 0.108 0.197 0.933
m536-m537 Zhang C48H44Ag2B 1128.2 P21/c 293 MoKa tube B SMART CCD 12917 27.1 0.024 5086 299 SAINT 0.053 0.131 0.990
m538-m540 Jones C49H39Cl2F 1004.1 P212121 180 MoKa tube N KappaCCD 29207 25.0 0.064 7894 560 HKL DENZO and 0.054 0.075 0.996
m541-m542 Kaludjerovi C8H16N2O10 351.2 C2/c 210 MoKa tube S P4 3486 29.0 0.019 1689 129 XSCANS 0.028 0.066 1.000
m543-m545 Li C28H22CoN3 523.4 P21/n 298 MoKa tube R R-AXIS-RAPID 10460 27.5 0.020 5432 323 CrystalStruct 0.063 0.130 1.000
m546-m547 Da-Jun C43H34FeO5 748.5 C2/c 298 MoKa tube CCD 7325 25.0 0.010 3203 232 B SHELXTL 0.037 0.083 0.998
m548-m550 Reinoso C26H34CuN4 658.1 P21/n 293 MoKa tube Xcalibur 12971 30.0 0.044 4480 211 CrysAlisRED 0.089 0.115 0.989
m551-m552 Yoshikawa C36H24Cl2F 920.7 P21/n 223 MoKa R R-AXIS-RAPID IP 27860 27.4 0.045 6212 475 TEXSAN 0.097 0.987
m553-m555 Sakai C8H24Br2N8 910.4 P-1 293 MoKa tube B SMART APEX CCD 13222 30.0 0.036 6122 246 SAINT 0.063 0.092 0.993
o903-o904 Jin C7H10N2O3 170.2 C2/c 293 MoKa tube B SMART Apex CCD 5170 28.1 0.032 2069 115 SAINT-Plus 0.084 0.077 0.977
o905-o906 Zhang C10H12N2O2 224.3 P-1 296 MoKa tube S P4 2611 26.5 0.009 2277 138 SHELXTL 0.046 0.096 0.964
o907-o909 Demir C6H18NO7P 247.2 P21 293 MoKa tube B SMART1000 CCD 9297 30.1 0.025 4714 284 SAINT 0.051 0.084 0.991
o910-o912 Jones C20H16N2 284.4 P43212 180 MoKa tube N KappaCCD 4236 27.5 0.029 1061 108 HKL DENZO and 0.043 0.100 0.972
o913-o916 Vembu C13H13N5O7 351.3 P21/c 100 MoKa tube CCD 24887 28.3 0.069 6947 555 SAINT 0.089 0.155 0.955
o917-o918 Sakai C22H21I2N3 613.2 P-1 296 MoKa tube B SMART APEX CCD 6983 27.5 0.019 4883 263 SAINT 0.050 0.102 0.925
o919-o921 Aree C19H17NO5 339.3 P212121 295 MoKa tube B SMART APEX CCD 9913 28.0 0.041 2104 294 SHELXTL and S 0.065 0.113 0.984
o922-o923 Kennard C19H18ClN3 467.2 P-1 293 Moka EN CAD-4 3933 25.0 0.006 3639 279 WinGX 0.041 0.087 1.000
o924-o925 Jerdioui C15H11NS 237.3 P212121 173 MoKa tube S CCD three-circl 9574 27.2 0.047 2438 155 SAINT 0.073 0.109 0.940
o926-o928 Gultekin C11H16OS2 228.4 P-1 293 MoKa tube S P4 2493 25.0 0.037 1983 147 SHELXTL 0.075 0.127 1.000
o929-o930 Bolte C16H23ClN2 278.8 P21/n 100 MoKa tube Stoe IPDS II 2C 27910 27.9 0.042 3833 184 X-AREA 0.036 0.070 0.996
o931-o933 Barnes C9H12NO4.5 206.2 C2/c 120 MoKa EN FR591 EN KappaCCD 10464 27.5 0.050 2284 152 DENZO and COL 0.044 0.095 0.992
o934-o935 Rupert C41H47O5P 650.8 P212121 133 MoKa tube SMART 1K CCD 15797 24.1 0.069 3158 424 SAINT 0.080 0.039 0.975
o936-o938 Vembu C13H11ClO3 282.7 Pna21 100 MoKa tube CCD 10721 28.3 0.034 3099 207 SAINT 0.041 0.094 0.980
o939-o941 Vembu C13H10Cl2O 317.2 P-1 100 MoKa tube CCD 8295 25.0 0.015 3074 212 SAINT 0.030 0.077 0.926
o942-o944 Lee C38H28N2O8 640.6 P-1 298 MoKa tube AFC7R 3049 25.0 0.016 2830 225 TEXSAN 0.109 0.054 1.000
o945-o946 Karadayi C18H10N2O 270.3 P21/c 293 MoKa tube STOE IPDS 2 4793 24.8 0.071 4793 380 STOE X-RED 0.081 0.074 0.994
o947-o949 Kavitha C12H8Cl2N2 267.1 P21/n 293 MoKa tube EN CAD-4 1179 25.0 0.015 1021 82 MolEN 0.063 0.140 0.997
o950-o951 Bolte C67H75BF16 1307.4 P21/c 173 MoKa tube STOE IPDS-II 2C 142757 25.5 0.182 30915 1585 X-AREA 0.293 0.273 0.990
o952-o954 Alagar C13H15N1O6 281.3 P1 293 MoKa tube EN CAD4 2541 25.0 0.013 2410 366 CAD-4 Softwar 0.043 0.085 0.997
o955-o958 Rajagopal C14H25.5Cl 509.1 C2 293 CuKa tube EN CAD-4 2054 68.0 0.017 2019 327 CAD-4 Softwar 0.039 0.109 0.999
o959-o961 Echeverria C8H10Br2O4 330.0 Pbca 110 MoKa tube B SMART 1K CCD 10606 28.2 0.041 1224 84 SAINT-NT 0.036 0.077 1.000
o962-o963 Clark C20H20O4 324.4 P-1 100 MoKa tube KappaCCD 9345 30.0 0.021 2480 109 DENZO and SCA 0.056 0.113 0.992
o964-o966 Thamotharan C9H9ClN4O 224.7 P-1 293 MoKa tube Stoe IPDS 4391 27.8 0.024 2060 145 IPDS Software 0.048 0.117 0.869
o967-o968 Poulsen C19H20N2O6 404.4 P212121 295 MoKa Rigaku RA R AFC-7R 3271 27.5 0.025 2796 254 TEXSAN for Wi 0.064 0.123 0.999
o969-o971 Lin C56H46N4O8 903.0 P21/c 293 MoKa tube B CCD 14839 28.3 0.057 5626 311 B SAINT 0.256 0.161 0.965
o972-o974 Smith C10H9N3O 187.2 P21/n 293 MoKa tube B CCD 4542 25.0 0.050 1566 140 SAINT 0.065 0.098 1.000
o975-o977 Cox C15H10O6 286.2 C2 120 MoKa N KappaCCD 8254 27.6 0.087 1471 204 DENZO and COLLECT 0.190 0.883
o978-o980 Meyers C23H22O1 314.4 Pccn 296 MoKa tube R AFC-5S 3143 25.0 0.000 3143 221 PROCESS in TE 0.152 0.167 0.999
o981-o982 Sun C23H14F6S2 468.5 C2/c 293 MoKa tube B P4 2244 25.0 0.024 1644 142 XSCANS 0.080 0.119 0.914
o983-o985 Cherouana C4H6N4O4 174.1 P-1 293 MoKa tube KappaCCD 3964 25.5 0.033 1206 109 DENZO and SCA 0.046 0.113 0.902
o986-o988 Cox C19H16ClNO 357.8 P-1 120 MoKa N KappaCCD 10585 27.5 0.056 3800 232 DENZO and COLLECT 0.105 0.977
o989-o991 Sun C31H52O4 488.7 P212121 296 MoKa tube S P4 3492 26.0 0.021 3203 316 XSCANS 0.098 0.158 0.998
o992-o993 Koning C12H16O3 208.3 P21/c 293 MoKa tube B SMART CCD 6472 26.0 0.049 2219 140 SAINT 0.082 0.179 0.998
o994-o996 Winkler C38H32N4O4 608.7 C2/c 143 MoKa tube B SMART 1000 CCD 22552 28.0 0.043 3818 218 SAINT 0.049 0.119 0.999
o997-o999 Winkler C26H40N4O4 472.6 P21/c 143 MoKa tube B SMART 1000 CCD 35207 26.4 0.037 5478 333 SAINT 0.054 0.104 1.000
o1000-o100Ocak C26H19N5O2 433.5 Pbca 293 CuKa tube N KappaCCD 6338 63.0 0.001 3484 298 HKL DENZO and 0.097 0.138 0.914
o1002-o100Camus C24H18Cl2N 437.3 P21/c 293 CuKa long tube N CAD-4 6211 71.9 0.014 3864 271 PLATON 0.061 0.135 1.000
o1004-o100Saad C14H13NO3 243.3 C2/c 293 MoKa tube B SMART APEX CCD 8106 27.5 0.033 2839 163 SAINT 0.059 0.130 0.990
o1006-o100Ivashevskaj C15H16N2O 240.2 P21/n 293 CuKa PW3373/00 Philips Analytical XPert PRO X-ray system 162 local program
o1009-o101Vembu C15H14O5S 306.3 P21/c 120 MoKa tube B SMART CCD 6K 15405 27.6 0.037 3289 246 SAINT 0.055 0.116 0.996
o1012-o101Thamotharan C14H12N2O4 272.3 Pbca 160 MoKa N FR591 t N KappaCCD 29914 26.0 0.067 2459 181 DENZO-SMN and 0.087 0.129 0.999
o1014-o101ozturk C24H36I2N4 666.4 P21/c 293 MoKa S SMART CCD 8590 28.3 0.017 3391 158 SAINT 0.075 0.114 0.963
o1017-o101Bjernemose C21H22N4 330.4 P21/n 120 MoKa B SMART CCD 20244 27.5 0.083 4019 227 SAINT 0.111 1.000
o1019-o102Vembu C27H24O9S3 588.6 P21/c 100 MoKa tube B CCD 33621 28.3 0.040 6509 448 SAINT 0.062 0.116 0.973
o1022-o102Krivokapic C12H8I2N2O 450.0 I2cb 150 MoKa N KappaCCD 2815 26.3 0.000 2681 296 DENZO and SCA 0.055 0.105 0.965
o1025-o102Li C47H44.50N 695.4 Pbca 293 MoKa tube B SMART-CCD 20973 25.0 0.050 7092 534 B SAINT 0.129 0.188 0.982
o1028-o102Ng C24H38N2O4 418.6 P-1 298 MoKa tube B AXS 5309 28.3 0.045 2756 144 SAINT 0.094 0.141 0.910
o1030-o103Chen C10H19NO9 297.3 Pbca 298 MoKa tube B AXS 12407 25.0 0.028 2305 209 SAINT 0.061 0.143 1.000
o1033-o103Vembu C17H14O3S 298.3 Pc 120 MoKa tube B SMART 6K CCD 20999 27.5 0.045 6450 379 SAINT-NT 0.052 0.112 0.998
o1036-o103Vembu C6H4ClNO4S 221.6 P21/n 120 MoKa tube B SMART CCD 6K 9420 27.5 0.028 1928 134 SAINT 0.045 0.106 0.998
o1039-o104Liu C22H22N2 314.4 P21/c 293 MoKa tube B Smart APEX CCD 4170 25.5 0.060 1530 99 SAINT 0.062 0.106 0.992
o1041-o104Abourichaa C14H15ClN2 278.7 P21/c 173 MoKa tube Stoe IPDS-II 2C 9173 25.2 0.063 2526 177 X-AREA 0.065 0.078 0.989
o1043-o104Jin C7H11.82Cl 235.5 P21/c 293 MoKa tube B Smart Apex CCD 6265 27.0 0.016 2417 135 SAINT 0.067 0.095 0.993
o1045-o104Francis C14H12ClNO 261.7 Pn21a 293 CuKa tube EN CAD-4 4C 1220 69.9 0.000 1220 163 MolEN 0.053 0.144 0.992
o1048-o104Kania-Korwe C6H2Cl3I 307.3 P21/n 90 MoKa tube N KappaCCD 6306 27.5 0.035 936 56 DENZO-SMN 0.037 0.078 0.994
o1050-o105Ray C13H16O4 236.3 P21/n 298 MoKa tube B CCD 7581 28.3 0.016 2821 155 SAINT 0.048 0.113 0.961
o1053-o105Isik C16H13FN4O 296.3 P-1 293 MoKa Stoe IPDS 2 3550 13.0 0.000 3550 212 X-RED 0.070 0.153 0.879
o1055-o105Zarychta C17H23P1O4 322.3 P21 293 MoKa tube Xcalibur 10929 25.0 0.029 6056 463 CrysAlisRED 0.061 0.084 0.996
o1058-o105Lynch C16H22N4O1 430.4 P-1 298 MoKa Rigaku RA R AFC7-R 6810 25.4 0.000 6810 577 TEXSAN 0.123 0.150 0.963
o1060-o106Clegg C7H13NO6 207.2 P212121 160 MoKa tube B SMART 1K CCD 5877 26.0 0.047 1352 149 SAINT 0.056 0.082 0.948
o1063-o106Wagner C16H13FN2O 348.3 P21 298 MoKa tube B P4 3910 27.5 0.048 1839 227 XSCANS 0.107 0.151 0.947
o1066-o106Zhou C21H13Cl4N 469.1 P-1 293 MoKa tube B SMART CCD 4239 25.0 0.017 3567 264 SAINT 0.059 0.105 0.995
o1068-o106Shi C19H12N2O4 332.3 P-1 293 MoKa tube B SMART CCD 3218 25.0 0.014 2700 226 SAINT 0.055 0.115 0.994
o1070-o107Clegg C22H29NO4S 431.6 P21 160 MoKa tube B SMART 1K CCD 7705 26.0 0.020 5239 268 SAINT 0.045 0.085 0.904
o1073-o107Umadevi C4H9NO5 151.1 P212121 293 MoKa tube EN CAD-4 1318 24.6 0.085 1132 93 CAD-4 Softwar 0.063 0.173 0.996
o1076-o107Lynch C15H35N4O1 455.5 P-1 298 MoKa tube EN CAD-4 4196 25.0 0.027 3937 289 Xtal3.2 0.081 0.208 0.999
o1079-o108Hughes C28H35NO4 449.6 P21 292 MoKa tube S SMART CCD 11309 27.6 0.018 3001 300 SAINT 0.069 0.151 0.971
o1082-o108Mahmoudkhan C11H17NS 195.3 C2/c 173 MoKa RA B P4 CCD 8741 25.4 0.066 2108 130 SAINT and SAD 0.087 0.114 0.999
o1084-o108Rajagopal C22H26Cl6N 675.2 C2 293 MoKa tube R AFC-5R 4124 30.1 0.013 4030 416 TEXSAN for Wi 0.109 0.117 0.836
E59 Part 8
i107-i109 ozturk Cu2H12N8O1 409.3 C2/c 293 MoKa tube S SMART CCD 3874 28.3 0.030 1624 100 SAINT 0.061 0.110 0.935
i110-i111 Bremm H18Cl6In2N 544.5 P-1 293 MoKa tube Stoe IP System 1719 26.0 0.023 1234 68 IPDS 0.033 0.073 0.806
i112-i115 Salyer Li0.70NbS2 161.9 P63/mmc 150 MoKa tube B SMART1000 CCD 974 25.0 0.034 85 9 SAINT and SHE 0.017 0.047 0.909
i116-i118 Cao GeH41.50Na 2828.5 P-1 296 MoKa R R-AXIS RAPID IP 18682 30.0 0.075 14383 586 teXsan Ver. 1.11 0.163 0.969
i119-i121 Helmholdt Ge3Pr4S12 1166.2 R3c 2930.653 synchrotr ESRF BM16 349 . 63 MRIA ?
i122-i124 Lee H20K4Na2O3 1339.9 P-1 298 MoKa tube Stoe Stadi-4 3845 27.5 0.000 3845 244 X-RED 0.041 0.094 0.998
m556-m558 Yim C14H36Cu2I 833.9 P21/c 173 MoKa tube B SMART CCD 5836 25.0 0.032 2641 128 SAINT 0.057 0.090 0.984
m559-m561 Sakai C14H28Cl4N 1128.4 Pnma 296 MoKa tube B SMART APEX CCD 16797 23.3 0.117 2317 221 SAINT 0.068 0.062 1.000
m562-m564 Rajagopal C6H22CoN4O 433.2 P21/n 273 MoKa tube CCD 5063 28.0 0.014 1968 115 SAINT 0.051 0.141 0.945
m565-m567 Vinodu C50H29Cl4N 939.0 P-1 110 MoKa tube N KappaCCD 19096 27.5 0.061 8956 559 DENZO 0.106 0.134 0.972
m568-m570 Yang C28H30CdN4 695.0 P-1 293 MoKa RA R R-AXIS RAPID 14103 27.4 0.049 6613 424 PROCESS-AUTO 0.038 0.107 0.990
m571-m573 Sbai C27H38Cl2C 684.5 P21/c 293 MoKa tube N KappaCCD 45369 26.4 0.037 6413 447 DENZO and SCA 0.045 0.097 0.958
m574-m575 Bekaert C10H18Br2N 423.5 P43 293 MoKa tube EN CAD-4 4956 30.0 0.062 2335 155 XCAD4 0.105 0.076 0.999
m576-m578 Muga C12H26N10N 427.9 P21/c 293 MoKa tube Stoe IPDS 11730 25.0 0.121 3410 218 X-RED 0.128 0.078 0.957
m579-m581 Ma C26H16Br2C 707.8 C2/c 296 MoKa tube R RAXIS-RAPID 10701 27.4 0.057 2917 186 CrystalStruct 0.088 0.135 0.997
m582-m583 Emen C20H20Cl2N 542.1 Pbca 203 MoKa tube B P4 6492 27.5 0.039 5178 281 SHELXTL 0.134 0.172 0.999
m584-m585 Aldridge C39.5H35Br 846.6 P21/c 150 MoKa tube N KappaCCD 55828 27.5 0.083 7893 386 DENZO-SMN) 0.044 0.071 0.998
m586-m587 Dale C8H10CaO7 258.2 P21/c 150 MoKa tube B SMART 1000 CCD 8282 26.0 0.055 2362 163 SAINT 0.079 0.143 0.916
m588-m590 Carballo C4H10CoO8 245.1 P21/c 293 MoKa tube CCD 5031 26.5 0.023 1964 142 SAINT 0.034 0.053 0.968
m591-m593 Butcher C6K2N6O8 362.3 C2/m 93 MoKa tube B CCD 2152 28.2 0.031 699 54 SAINT 0.026 0.063 0.987
m594-m595 Awang C27H31NS2S 552.3 P-1 293 MoKa tube B SMART APEX CCD 16186 27.5 0.022 5793 282 SAINT 0.027 0.071 0.990
m596-m598 Bremner C4H18Cl4Mn 439.0 P21/n 293 MoKa tube B SMART1000 CCD 8334 32.5 0.023 2947 97 SAINT 0.050 0.078 0.989
m599-m601 Candiota C54H40O2P2 1104.7 P-1 120 MoKa EN FR591 N KappaCCD 43340 27.6 0.050 22769 1207 DENZO and COL 0.073 0.168 0.992
m602-m604 Filippou C54.50H54C 1087.6 C2/c 180 MoKa tube Stoe IPDS 32126 25.5 0.056 8465 553 IPDS2.87 0.047 0.084 0.951
m605-m607 Zhou C20H16ClCu 461.4 P-1 293 MoKa tube B CCD 5452 26.5 0.044 3871 327 SAINT and SHE 0.039 0.088 0.977
m608-m610 Li C43H47Cl2C 1171.5 C2/c 293 MoKa tube B CCD 19837 30.0 0.061 7345 322 SMART 0.126 0.082 0.997
m611-m613 Tao C28H28Cd2N 1047.4 P21/n 298 MoKa tube B APEX 10511 28.3 0.022 4075 271 SAINT 0.033 0.063 0.930
m614-m615 Tao C32H36CuN4 716.2 Pbcn 298 MoKa tube B AXS 17912 28.3 0.045 3768 240 SAINT 0.077 0.120 0.960
m616-m617 Failes C18H18Cl3C 527.6 P21/c 150 MoKa tube B CCD 31017 33.0 0.025 7781 289 SAINT-Plus 0.031 0.074 0.981
m618-m619 Sui-Seng C48H42Cl4P 1035.4 P21/c 220 CuKa tube B AXS SMART 2K/Pl 26449 72.8 0.059 4387 253 SAINT 0.037 0.089 1.000
m620-m621 Sui-Seng C42H72Cl4P 993.6 P21/c 293 CuKa tube B AXS SMART 2K Pl 27337 72.7 0.063 4457 226 SAINT 0.039 0.083 1.000
m622-m624 Li C10H16N4O8 449.8 P21/n 298 MoKa tube R AFC-7S 3688 26.0 0.025 3496 225 TEXSAN 0.164 0.189 1.000
m625-m626 Lerner C8H16F6LiN 407.3 P21/n 173 MoKa tube Stoe IPDS-II 2C 17018 24.7 0.045 2866 221 X-AREA 0.050 0.058 0.991
m627-m629 Chaudhuri C40H52N8Ni 986.3 P21/c 293 MoKa tube EN CAD-4 4064 25.0 0.040 3850 313 XCAD4 in WinG 0.078 0.145 0.997
m630-m632 Stibrany C34H70Cl3C 1137.6 C2/c 223 MoKa tube B CCD 12812 25.0 0.031 4350 263 SAINT 0.048 0.092 0.984
m633-m635 Ocando-Mava C16H26O3PR 400.3 P212121 293 MoKa tube R AFC-7S 3098 25.0 0.013 2795 190 TEXSAN 0.026 0.049 0.974
m636-m638 Sakai C24H24N6O1 946.7 P-1 296 MoKa tube B SMART APEX CCD 7744 26.4 0.039 5485 379 SAINT 0.074 0.072 0.967
m639-m641 Srinivasan C4H12CrN2O 204.2 P21/n 293 MoKa tube Stoe AED-II 4C 4578 30.0 0.035 2350 101 REDU4 0.034 0.082 1.000
m642-m643 Chee C64H50Cl6N 1421.2 P-1 168 MoKa tube S P4/CCD SMART 18009 26.4 0.021 5840 378 SAINT 0.026 0.062 0.950
m644-m646 Ferguson C28H42BMoN 643.5 C2/c 294 MoKa tube EN CAD-4 6846 27.0 0.013 6761 380 DATRD2 in NRC 0.080 0.091 1.000
m647-m651 Rojas C14H11KO3 266.3 P21/c 293 MoKa B SMART CCD 15415 26.5 0.040 2864 167 SAINT 0.058 0.120 0.919
m652-m654 Reger C14.50H14. 452.4 P-1 150 MoKa tube B SMART APEX CCD 14485 26.4 0.020 6448 449 SAINT-Plus-NT 0.026 0.062 0.995
m655-m657 Ali C34H36N4O6 791.5 P-1 293 MoKa tube B SMART APEX CCD 10556 27.5 0.019 3804 221 SAINT 0.025 0.068 0.970
m658-m660 Boixassa C17H30BF4N 500.2 P21/c 293 MoKa Stoe IPDS 16245 26.1 0.027 4070 260 X-RED 0.048 0.117 0.970
m661-m663 Wharf C32H36Sn 539.3 P-421c 293 CuKa tube EN CAD-4 20587 70.0 0.071 1390 78 NRC-2 and NRC 0.043 0.099 1.000
m664-m665 Akkurt C16H10GeN2 367.0 P21/c 293 MoKa tube S SMART CCD 19939 28.3 0.046 7949 379 SAINT 0.109 0.100 0.980
m666-m668 Zhao C12H18K5Mn 716.7 P-1 298 MoKa tube B APEX 7084 25.0 0.024 4168 337 SAINT 0.079 0.161 0.990
m669-m670 Vieille-Pet C26H37F6OP 813.7 Imma 153 MoKa tube STOE IPDS 9851 25.9 0.085 1505 107 INTEGRATE 0.047 0.078 0.993
m671-m673 Li C8H13CrN2N 364.2 P21/c 295 MoKa tube R R-AXIS RAPID 11982 27.5 0.017 6141 388 CrystalStruct 0.044 0.075 1.000
m674-m675 Schormann C8H24Cl6OS 573.0 Pna21 140 MoKa RA R R-AXIS-IIc 11796 25.4 0.053 4153 201 DENZO and SCA 0.030 0.077 0.994
m676-m678 Crocock C16H21MnO2 300.3 P21/n 298 MoKa tube Nicolet P3 4669 30.0 0.016 4318 180 RDNIC 0.068 0.133 1.000
m679-m680 Mirza C50H58Br2F 1511.0 C2/c 293 MoKa tube N KappaCCD 21516 27.5 0.046 6741 341 DENZO-SMN 0.055 0.115 0.990
m681-m683 Srinivasan C6H16N2S4W 428.3 Pbca 293 MoKa tube Stoe IPDS 23034 28.0 0.041 2946 119 IPDS 0.031 0.067 0.962
m684-m686 Callejo C58H70B2N6 1086.2 P21/n 293 MoKa tube EN CAD-4 8287 30.0 0.046 7975 343 XCAD4 0.103 0.126 0.998
m687-m689 McAdam C22H16FeN2 428.2 P21/c 164 MoKa tube B CCD 22614 26.4 0.027 3620 262 SAINT 0.036 0.076 0.990
m690-m691 Zhao C24H16CoN1 565.4 Iba2 223 MoKa tube B AXS SMART CCD 8877 30.0 0.037 3200 178 SHELXTL 0.038 0.082 0.998
m692-m694 Cai C12H36Cd2N 765.3 Pna21 298 MoKa tube B SMART 23153 27.4 0.047 6164 361 SAINT 0.072 0.085 1.000
m695-m697 Panosyan C17H25CoN6 516.4 P212121 150 MoKa tube N KappaCCD 9702 27.5 0.102 4948 308 DENZO-SMN 0.103 0.153 0.992
o1087-o108Dale C10H10O10 290.2 P-1 160 MoKa tube B SMART 1K CCD 1735 25.0 0.012 1010 99 SAINT 0.038 0.096 0.988
o1089-o109Britton C12H18O2 194.3 I41/a 174 MoKa tube S SMART 5239 25.1 0.025 990 70 SAINT 0.050 0.104 0.999
o1092-o109Jones C6H6Br3N 331.9 P21/m 133 MoKa tube B SMART 1000 CCD 7449 30.0 0.041 1408 68 SAINT 0.035 0.074 0.999
o1095-o109Caddy C7H10O5 174.2 P212121 293 MoKa tube SMART CCD 1K 5322 28.3 0.038 1107 127 SAINT-Plus an 0.043 0.072 0.998
o1098-o110Winkler C38H56N4O4 632.9 P-1 143 MoKa tube B SMART 1000 CCD 15921 26.4 0.038 7098 433 SAINT 0.061 0.105 0.996
o1101-o110Winkler C30H48N4O4 528.7 P21/n 133 MoKa tube B SMART 1000 CCD 19202 26.0 0.051 6300 353 SAINT 0.074 0.114 0.999
o1103-o110Winkler C30H48N4O4 528.7 P-1 133 MoKa tube B SMART 1000 CCD 17805 28.0 0.033 7353 373 SAINT 0.061 0.116 0.992
o1106-o110Winkler C30H48N4O4 528.7 P-1 143 MoKa tube B SMART 1000 CCD 14409 26.3 0.025 6352 373 SAINT 0.056 0.103 0.997
o1108-o111Cox C8H6O5 182.1 P21/m 120 MoKa N KappaCCD 5614 27.6 0.080 859 70 DENZO and COLLECT 0.215 0.975
o1111-o111Atalay C18H16N2O 276.3 P21/n 293 MoKa tube Stoe IPDS-2 14570 29.5 0.037 4223 194 X-RED 0.103 0.219 0.974
o1113-o111Fischer C8H8O3 152.2 P21/c 299 CuKa tube B-N KappaCCD 10243 66.5 0.048 2590 199 DENZO and SCA 0.065 0.149 0.987
o1117-o111Thamotharan C22H20N2O3 360.4 Pna21 160 MoKa N FR591 t N KappaCCD 24574 25.0 0.065 1728 249 DENZO-SMN and 0.044 0.096 0.997
o1120-o112Thamotharan C14H17NO3 247.3 C2/c 160 MoKa N FR591 t N KappaCCD 26182 27.5 0.056 2900 176 DENZO-SMN and 0.095 0.213 0.997
o1123-o112Rodriguez C12H11N 169.2 P-1 168 MoKa tube CCD 23981 25.1 0.036 12700 961 SAINT+ and SH 0.108 0.115 0.974
o1126-o112Gilardi C40H40N4O4 640.8 P21/c 295 CuKa tube B SMART-CCD 10138 67.2 0.096 2938 218 SHELXTL 0.074 0.139 0.940
o1128-o112Chen C25H16Cl3N 544.8 P-1 293 MoKa tube B CCD 9829 26.4 0.026 4851 377 SAINT 0.079 0.142 0.990
o1130-o113Oku C14H24N2O5 300.4 P21 173 CuKa R RAXIS-RAPID 31310 68.3 0.040 2134 217 CrystalStructure 0.193 0.977
o1133-o113Lynch C18H14O8 358.3 P21/c 120 MoKa BN FR591 B N KappaCCD 10673 27.5 0.090 1884 131 DENZO and COL 0.102 0.116 0.997
o1135-o113Reck C16H14N2O 250.3 C2/c 293 MoKa tube EN CAD-4 1207 25.1 0.030 1155 89 PROCESS in Mo 0.072 0.156 1.000
o1137-o113Ocak C10H11ClN4 238.7 P21/c 293 MoKa tube Stoe IPDS-II 3218 29.4 0.000 3218 145 X-RED 0.100 0.205 0.994
o1139-o114Wang C30H32ClNO 474.0 P21/n 296 MoKa tube S P4 5509 25.3 0.012 4826 313 SHELXTL 0.078 0.103 1.000
o1141-o114Ray C18H18O5 314.3 P21/n 298 MoKa tube B CCD 9924 28.3 0.020 3824 211 SAINT 0.060 0.139 0.958
o1143-o114Ravishankar C17H16O4 284.3 P21/n 293 MoKa tube S SMART CCD 9034 28.3 0.014 3530 255 SAINT 0.048 0.119 0.972
o1146-o114Selvi C17H17NO3 283.3 C2/c 293 MoKa tube S SMART CCD 7214 25.0 0.034 2644 192 SAINT 0.116 0.217 0.997
o1149-o115Butcher C6H8N8O8 320.2 C2/m 294 CuKa tube B CCD 2066 66.8 0.045 545 54 SAINT 0.035 0.085 0.984
o1151-o115Silva C17H38BrN 336.4 P21/c 293 CuKa tube EN CAD-4 6399 72.6 0.034 3750 176 HELENA 0.053 0.101 0.982
o1153-o115Xin C10H12N2S4 288.5 P21/n 293 MoKa tube B CCD 3664 26.4 0.027 1336 74 SAINT and SHE 0.045 0.076 0.998
o1155-o115Ho C8H9N1O1S1 167.2 P-1 223 MoKa tube B AXS SMART CCD 3446 30.0 0.020 2365 100 SHELXTL 0.041 0.108 0.980
o1157-o115Lynch C27H37N7O1 683.6 P-1 298 MoKa tube EN CAD-4 11786 25.0 0.011 11286 922 Xtal3.2 0.121 0.206 0.999
o1159-o116Emen C12H13ClN2 268.8 P-1 293 MoKa tube B P4 3181 26.4 0.023 2552 155 SHELXTL 0.086 0.107 0.988
o1161-o116Zhao
o1163-o116Fallon C18H28N2 272.4 P22121 123 MoKa N KappaCCD 11552 27.5 0.043 1174 93 HKL DENZO and SCALEP 0.084 0.992
o1165-o116Isik C10H9FN4O 220.2 P21/c 293 MoKa Stoe IPDS-II 10015 29.5 0.000 2861 147 X-RED 0.061 0.107 0.992
o1167-o116Yufit C24H24 312.4 P21/c 120 MoKa tube B SMART CCD 1K 21455 30.4 0.062 5105 313 SAINT 0.082 0.117 0.942
o1170-o117Celli C21H25N3O5 399.4 P21/c 293 MoKa tube S P4 4895 25.0 0.031 3612 276 XSCANS 0.139 1.000
o1173-o117Shan C12H14N4O4 278.3 P-1 296 MoKa tube R R-AXIS RAPID 4526 27.4 0.015 2883 182 CrystalStruct 0.076 0.123 0.982
o1175-o117Roblou C72H100.50 1324.0 P-1 293 MoKa tube Stoe IPDS 25502 25.0 0.055 11727 841 XRED 0.113 0.155 0.942
o1178-o118Marciniak C15H14I2N2 475.8 P21/c 293 MoKa tube DARCH-1 3784 27.5 0.050 3622 172 DARCH package 0.047 0.095 1.000
o1181-o118Zhang C15H24BrN 298.3 P21/c 100 MoKa tube Stoe IPDS-II 2C 34535 27.7 0.043 3605 160 X-AREA 0.032 0.049 0.994
o1183-o118Koysal C17H12N2O 260.3 Pna21 150 MoKa tube B CCD 9839 28.7 0.021 1777 181 SAINT 0.070 0.178 0.939
o1185-o118Zhou C20H42CdO1 683.1 P21 298 MoKa tube B AXS 8977 27.1 0.021 5451 370 SAINT 0.054 0.116 0.980
o1187-o118Gilardi C21H18F3N3 561.6 Pnma 293 MoKa tube B P4 2707 26.0 0.015 2390 173 SHELXTL 0.049 0.096 1.000
o1189-o119Cox C23H26ClNO 431.9 P21/n 120 MoKa N KappaCCD 26128 27.5 0.047 4955 282 DENZO and COLLECT 0.092 0.994
o1192-o119Vembu C19H20N4O6 400.4 P212121 120 MoKa tube B Proteum M 12716 27.2 0.048 2355 322 SAINT 0.058 0.065 0.996
o1196-o119Pozzi C15H17NO6 307.3 P21/c 100 MoKa tube B SMART 1K CCD 16953 30.4 0.037 3978 267 SAINT-NT 0.066 0.116 0.931
o1199-o120Navarro C16H15N5 277.3 Pbca 150 MoKa tube B SMART CCD 8858 25.0 0.023 1188 109 SAINT 0.040 0.084 1.000
o1202-o120Onoda C46H36N2O3 664.8 P21/c 296 MoKa tube R R-AXIS RAPID IP 34653 27.5 0.075 7998 469 TEXSAN 0.128 0.136 0.993
o1205-o120Dale C14H18O10S 410.4 P-1 150 MoKa tube B SMART 1000 CCD 4046 26.0 0.010 2112 126 SAINT 0.031 0.075 0.871
m1208-m120Wang C11H10O5 222.2 P21 298 MoKa tube B APEX 2438 25.0 0.040 897 151 SAINT 0.069 0.127 0.990
o1210-o121Wang C21H18N2O2 330.4 P21/c 296 MoKa tube S P4 3660 25.3 0.010 3147 236 SHELXTL 0.067 0.093 1.000
o1213-o121Vembu C12H9NO5S 279.3 Pna21 120 MoKa Bede micr B Proteum M 7868 27.5 0.059 2392 199 SAINT 0.065 0.060 0.999
o1216-o121Vembu C14H11NO7S 337.3 P21/c 120 MoKa Bede micr B Proteum M 9472 27.2 0.030 3150 241 SAINT 0.054 0.082 0.993
o1220-o122Hokelek C16H21NO5 307.3 P21/n 293 MoKa tube EN CAD-4 3141 26.3 0.051 2994 263 XCAD4 0.176 0.099 1.000
o1223-o122ozdemir C15H13ClN4 300.7 P-1 293 MoKa tube Stoe IPDS 2 2327 24.8 0.044 2327 242 X-RED 0.044 0.126 0.935
o1226-o122Gilardi C6H14N2O10 274.2 P-1 93 MoKa tube B SMART CCD 2086 28.2 0.020 1288 94 SAINT 0.054 0.108 0.959
o1228-o123McLean C20H16O1 272.3 P21/c 296 MoKa tube R AFC-5S 2804 25.1 0.027 2620 192 PROCESS in TE 0.106 0.142 1.000
o1231-o123Zhao C12H16N3O2 234.3 C2/c 223 MoKa tube B AXS SMART CCD 4911 30.0 0.020 1753 79 SHELXTL 0.062 0.152 0.999
o1233-o123Wang C12H12O5 236.2 P21 298 MoKa tube B AXS 8222 25.0 0.039 2154 309 SAINT 0.067 0.123 1.000
o1235-o123Wang C11H12O3 192.2 Pna21 298 MoKa tube B APEX 12924 25.0 0.070 897 129 SAINT 0.065 0.156 1.000
o1237-o123Kayhan C12H13ClN2 268.8 Pna21 150 MoKa tube B CCD 6878 26.4 0.037 2054 158 SAINT 0.035 0.081 0.998
o1239-o124Sharon C15H18ClNO 295.8 C2/c 293 MoKa tube B P4 3556 26.0 0.023 2866 172 XSCANS 0.094 0.119 1.000
E59 Part 9
i125-i128 Kolitsch Fe1.84HMg0 218.6 P21/a 293 MoKa tube N KappaCCD 10662 32.6 0.014 5432 314 HKL DENZO and 0.033 0.065 0.999
i129-i130 Haghiri C5BrMnO5 274.9 Pnma 100 MoKa tube Stoe IPDS-II 2C 9213 27.6 0.074 958 61 X-AREA 0.046 0.076 0.992
i131-i133 Saada F12K2OZr3 595.9 R-3m 293 D8 B 470 26
m698-m699 Zhu C8H10AgN5O 396.1 P21/n 293 MoKa tube S SMART CCD 5663 26.0 0.033 2492 191 SAINT 0.077 0.102 0.996
m700-m702 Clegg C45H44I2N2 1067.0 Cmc21 160 MoKa tube B SMART 1K CCD 14181 26.0 0.030 5016 270 SAINT 0.027 0.066 0.942
m703-m704 Hansen C27H22CrO7 510.5 Pc21n 298 MoKa tube EN CAD-4 2315 25.0 0.000 2315 318 XCAD4 0.062 0.113 0.999
m705-m706 Binzet C41H30Cl4N 875.3 P-1 173 MoKa tube B SMART CCD 11475 26.4 0.038 7764 487 SAINT 0.084 0.063 0.976
m707-m709 Marques C28H24AsAu 752.5 P21/c 173 MoKa B SMART CCD 35747 33.0 0.025 9482 334 SAINT 0.025 0.043 0.959
m710-m712 Ferguson C8H16Cu2O1 399.3 C2/c 293 MoKa tube S SMART CCD 3874 25.0 0.030 1624 100 SAINT 0.058 0.096 0.940
m713-m714 Lopez-Torre C17H16ClN3 448.5 P-1 296 CuKa RA B SMART CCD 10236 70.4 0.042 3309 211 SAINT-Plus-NT 0.028 0.071 0.936
m715-m716 Okabe C40H28CuN2 696.2 P-1 296 MoKa R AFC-5R 3834 27.5 0.018 3632 223 TEXSAN 0.152 1.000
m717-m718 Li C15H21CoNa 379.2 R-3c 100 MoKa tube CCD 6796 26.0 0.039 548 37 SAINT 0.068 0.119 0.942
m719-m721 Zhao C38H46N6Ni 805.5 P-1 223 MoKa tube B AXS SMART CCD 8055 30.0 0.022 5468 256 SHELXTL 0.062 0.123 0.977
m722-m723 Zhao C28H24Cu2N 711.7 C2/c 223 MoKa tube B AXS SMART CCD 11979 30.0 0.032 4259 210 SHELXTL 0.048 0.101 0.995
m724-m725 Harbach C10H18O6Zn 299.6 P21/c 100 MoKa tube Stoe IPDS-II 2C 10528 28.7 0.058 1601 89 X-AREA 0.023 0.056 0.996
m726-m728 Zhu C12H12AgF3 409.1 P-1 298 MoKa tube S SMART CCD 3984 25.0 0.015 2720 199 SHELXTL 0.054 0.133 0.983
m729-m730 Sun C4H22Mo5N4 1035.9 C2/c 298 MoKa RA R Weissenberg IP 2782 27.5 0.000 2782 173 TEXSAN 0.034 0.045 0.999
m731-m733 Yang C24H10N2Na 921.8 C2/m 298 MoKa tube B APEX 7636 28.3 0.035 1629 130 SAINT 0.033 0.072 0.950
m734-m735 Yang C14H18N2Ni 555.7 P-1 298 MoKa tube B APEX 5415 28.3 0.041 2152 163 SAINT 0.070 0.142 0.930
m736-m738 Bulut C34H30.50C 806.1 C2/c 293 MoKa tube Stoe IPDS-2 4607 29.4 0.000 4607 267 X-RED 0.055 0.100 0.990
m739-m741 Lee C3H15AsN2O 234.1 P21/n 293 MoKa tube B SMART1000 CCD 8758 32.5 0.022 3224 103 SAINT 0.035 0.051 0.994
m742-m744 Richards-Jo C16H42N10O 1056.4 P21/n 150 MoKa tube N KappaCCD 27454 27.7 0.027 7950 519 DENZO-SMN 0.028 0.055 0.983
m745-m747 Krivokapic C20H35BN4N 465.0 P-1 150 MoKa EN KappaCCD 16886 25.0 0.010 7437 541 DENZO/SCALEPA 0.045 0.038 0.953
m748-m749 Krivokapic C28H48B2N4 585.1 P21/c 150 MoKa EN KappaCCD 3497 27.3 0.030 2934 178 DENZO/SCALEPA 0.031 0.031 0.991
m750-m752 Xue C10H10CoN2 297.1 P21/n 295 MoKa tube R R-AXIS RAPID 7470 25.3 0.019 1995 163 CrystalStruct 0.043 0.101 0.990
m753-m755 Liu C18H18CoN4 445.3 P-1 150 MoKa tube B SMART CCD 2497 25.2 0.053 1623 133 SAINT 0.080 0.113 0.990
m756-m758 Nandhini C3H9CdCl2N 290.4 P21/c 293 MoKa tube EN sealed tube 1797 25.3 0.095 1541 94 CAD-4 Softwar 0.049 0.134 0.999
m759-m761 Ren C4H42CoMo4 1544.9 P21/n 298 MoKa tube B SMART CCD 12461 26.4 0.058 4434 295 SHELXTL 0.077 0.069 0.975
m762-m764 Doran C10H28N4O2 1128.7 Pbca 150 MoKa EN KappaCCD 6194 27.3 0.020 2219 182 DENZO/SCALEPACK 0.053 0.992
m765-m767 Doran C6H20N2O12 614.4 P-1 150 MoKa EN Kappa CCD 6840 27.5 0.020 3353 209 DENZO and SCALEPACK 0.047 0.989
m768-m770 Williams C27H25AuBr 718.3 P21/c 295 MoKa Rigaku RA R AFC-7R 6598 27.5 0.027 6045 299 TEXSAN for Wi 0.056 0.079 0.999
m771-m773 Lin C31H26CoN8 633.5 P21/n 295 MoKa tube R R-AXIS RAPID 20267 25.2 0.051 5357 397 CrystalStruct 0.065 0.092 0.980
m774-m776 Khan C52H70N2P2 980.1 P21/a 150 MoKa B-N KappaCCD 35095 25.0 0.070 4221 260 HKL DENZO and SCALEP 0.062 0.996
m777-m779 Zhu C34H46N6Ni 693.6 P21/c 298 MoKa tube B SMART CCD 8924 25.0 0.050 3085 209 SHELXTL 0.088 0.145 1.000
m780-m783 Sakai C26H44Cl6N 1547.6 P-1 296 MoKa tube B SMART APEX CCD 14233 23.3 0.164 7033 613 SAINT 0.200 0.108 0.998
m784-m786 Kalinina C6H20Er2O2 778.7 P21/c 173 MoKa tube B SMART1000 CCD 11931 36.3 0.037 4504 158 SAINT-Plus 0.032 0.070 0.992
m787-m789 Bell C24H20ClN6 514.9 P-1 173 MoKa tube B SMART CCD 12525 27.5 0.036 5304 325 SAINT and SHE 0.070 0.112 0.989
m790-m791 Thorn C3H12CdI4N 696.2 P21/c 83 MoKa tube B/S SMART APEX 17982 25.0 0.034 2418 91 SAINT-Plus 0.021 0.045 0.998
m792-m793 Pavlova C10H22Cl2C 304.7 C2 300 MoKa tube EN TurboCAD-4 1379 25.9 0.090 1289 70 XCAD4 0.050 0.151 0.999
m794-m796 Wharf C24H12Cl8S 702.6 C2/c 293 MoKa tube R AFC6S 19754 26.0 0.099 5195 299 DARTD2 in NRC 0.086 0.123 1.000
m797-m799 Bremner C6H22Cl4N2 386.8 P212121 120 MoKa tube N KappaCCD 10211 27.5 0.044 3303 155 COLLECT 0.028 0.075 0.994
m800-m802 Castillo C12H18CuK2 600.1 P-1 294 MoKa tube Oxford Xcalibur 11367 30.6 0.091 6673 349 CrysAlisRED 0.098 0.158 0.990
m803-m805 Sieron C8H16CuN2O 283.8 Pmmn 293 MoKa Siemens t S P3 719 28.0 0.000 719 66 XDISK in SHEL 0.024 0.062 1.000
m806-m808 Therrien C13H17Cl3N 440.6 C2/c 153 MoKa tube Stoe IPDS 8555 25.9 0.052 3136 190 INTEGRATE in 0.061 0.079 0.977
m809-m811 Wu C16H17Co1N 416.3 P21/c 293 MoKa tube B SMART CCD 21949 27.5 0.039 7932 479 SAINT 0.070 0.109 0.990
m812-m813 Choi C12H26Cr2K 700.6 C2/m 296 MoKa RA R AFC-5R 2000 30.0 0.025 1869 99 TEXSAN 0.097 0.179 0.980
m814-m815 Chen C18H16N2O4 389.7 P21/c 294 MoKa tube S SMART CCD 5060 27.6 0.035 1820 115 SHELXTL 0.056 0.117 0.997
m816-m817 Lerner C28H60Cl2G 669.0 Pbcn 173 MoKa tube STOE IPDS II 2C 47335 29.3 0.061 4663 164 X-AREA 0.046 0.059 0.997
m818-m820 Bond C60H76N4Ni 912.0 P21/n 1500.689 synchrotr B SMART CCD 69934 24.2 0.053 27810 1187 SAINT 0.088 0.129 0.900
m821-m823 Zhou C10H8CdCl2 339.5 C2/c 293 MoKa tube S SMART CCD 1693 25.0 0.019 954 70 SAINT 0.065 0.984
m824-m826 Zhang C30H26Cl2C 809.0 P-1 293 MoKa tube B SMART APEX CCD 7700 25.0 0.048 5970 469 SAINT 0.133 0.122 0.991
m827-m829 Panosyan C13H23Br2N 446.5 P21 150 MoKa tube N KappaCCD 12530 27.5 0.064 7418 344 DENZO-SMN 0.054 0.131 0.991
o1241-o124Imai C13H14N2O6 294.3 P1 295 MoKa tube R AFC-7S 1680 27.5 0.030 1575 193 TEXSAN 0.129 0.221 0.997
o1244-o124Wang C14H10O7 290.2 P21/c 296 MoKa tube B AXS 2615 27.5 0.000 2615 201 SAINT 0.044 0.119 0.953
o1246-o124Liu C22H17NO3 343.4 P21/c 291 MoKa tube S P4 3489 25.0 0.014 3016 242 SHELXTL 0.069 0.101 1.000
o1249-o125Liu C24H27N3S6 549.9 P21/n 293 MoKa tube B SMART CCD 12608 25.0 0.069 4772 360 SAINT and SHE 0.147 0.114 0.998
o1251-o125Gultekin C7H14O5S2 242.3 P21/n 293 MoKa tube S P4 1933 26.0 0.052 1800 171 SHELXTL 0.069 0.068 1.000
o1254-o125Chen C57H49Cl3N 1154.3 P212121 294 MoKa tube S CCD 39041 27.5 0.043 13342 725 SHELXTL 0.084 0.147 0.997
o1257-o125Clegg C24H22N2O4 402.4 P212121 173 MoKa tube B SMART 1K CCD 6519 25.0 0.158 1863 273 SAINT 0.113 0.090 0.921
o1259-o126Ohba C14H20Cl3N 404.7 P41 297 MoKa R AFC-7R 3009 27.5 0.016 2388 218 TEXSAN 0.171 1.000
o1261-o126Ohba C30H20F2O4 482.5 Pccn 298 MoKa R AFC-7R 3523 27.5 0.010 2622 164 TEXSAN 0.190 1.000
o1263-o126Shi C23H21NO3 359.4 P-1 292 MoKa tube S P4 3602 25.0 0.012 3264 255 SHELXTL 0.064 0.117 0.997
o1265-o126Wu C18H18O5 314.3 P-1 296 MoKa tube S P4 3072 25.0 0.014 2731 211 SHELXTL 0.057 0.102 0.999
o1267-o126Harrison C6H18NO6P 231.2 P21 293 MoKa tube B SMART1000 CCD 3955 27.6 0.028 2362 140 SAINT 0.059 0.087 0.984
o1270-o127Glass C7H11NO2 141.2 Pna21 200 MoKa tube B SMART CCD 6311 28.3 0.029 880 94 SAINT 0.039 0.081 1.000
o1272-o127Thamotharan C20H19BrN4 459.3 P-1 293 MoKa tube Stoe IPDS 19783 29.5 0.026 10124 528 IPDS 0.078 0.126 0.912
o1275-o127Bjernemose C36H40N6O 572.7 P21/n 180 MoKa B SMART CCD 16542 24.7 0.052 5388 392 SAINT 0.138 0.995
o1277-o127Coruh C16H28N6O2 336.4 P21/c 293 MoKa tube EN CAD-4 MACH3 1975 26.0 0.023 1817 110 XCAD-4 0.093 0.136 1.000
o1280-o128Li C46H39Cl2N 766.7 P21/c 293 MoKa tube B CCD 15867 25.0 0.055 6770 497 SAINT 0.119 0.128 0.992
o1283-o128Evans C30H22 382.5 P21 294 CuKa tube S P4 2001 68.8 0.038 2001 273 SHELXTL 0.105 0.168 0.999
o1286-o128Gilardi C17H16F2N2 414.4 P21/n 294 CuKa tube B SMART CCD 9044 67.1 0.032 3177 309 SAINT 0.048 0.124 0.942
o1288-o128Li C22H20N4O2 404.5 P-1 293 MoKa tube B SMART CCD 5754 26.4 0.015 4015 263 SAINT 0.059 0.101 0.988
o1290-o129Song C9H16N2O2S 216.3 P212121 273 MoKa tube B SMART CCD 4477 25.0 0.047 2047 128 SAINT 0.088 0.120 0.998
o1293-o129Rybakov C18H17NOS 295.4 P21/c 293 CuKa tube EN CAD-4 3201 74.9 0.021 2997 195 XCAD4 0.049 0.116 0.959
o1296-o129Ritchie C2H8N4O4Se 231.1 P-1 293 MoKa tube B SMART1000 CCD 3843 32.5 0.016 2591 100 SAINT 0.037 0.078 0.956
o1299-o130Lynch C15H14Cl2N 325.2 P-1 220 MoKa tube Stoe Stadi-4 3678 25.0 0.019 2570 196 REDU4 0.055 0.109 0.961
o1301-o130Bhaskaran C23H28N2O2 364.5 P-1 293 MoKa tube CCD 6035 25.0 0.014 4223 244 SAINT 0.082 0.179 0.910
o1304-o130Bhaskaran C32H30N2O4 570.7 P-1 293 MoKa tube CCD 9187 25.0 0.017 6389 363 SAINT 0.071 0.142 0.915
o1307-o130Li C28H23ClN4 531.0 P21/c 293 MoKa tube B SMART CCD 14310 26.4 0.069 5109 335 SAINT 0.126 0.104 0.998
o1309-o131Kanazawa C7H11NO3 157.2 P21/a 288 MoKa tube R R-AXIS IV 3732 25.0 0.048 1347 112 PROCESS 0.054 0.159 0.921
o1312-o131Zou C18H18N4 290.4 C2/c 293 MoKa tube B SMART CCD 3292 26.4 0.023 1534 104 SAINT 0.071 0.111 0.993
o1314-o131Lynch C48H63Cl6N 1142.8 P21/n 150 MoKa tube Stoe Stadi-4 9857 25.0 0.025 9532 734 REDU4 0.123 0.222 0.935
o1318-o132Batsanov C25H9N7O4 471.4 P-1 120 MoKa tube B SMART 1K CCD 6896 26.4 0.047 4232 325 SAINT 0.102 0.106 0.989
o1321-o132Nandhini C20H18O3 306.3 P21/c 150 MoKa tube B SMART CCD 21162 30.5 0.036 4750 209 SAINT 0.068 0.149 0.948
o1324-o132Ejsmont C5H5BO4 139.9 P21/n 100 MoKa tube Xcalibur 3391 25.5 0.089 1126 111 CrysAlisRED 0.067 0.132 0.994
o1327-o132Low C26H20N6 416.5 P-1 120 MoKa tube N KappaCCD 19117 25.0 0.050 4637 291 DENZO-SMN 0.054 0.110 0.994
o1330-o133Low C27H21N5 415.5 P-1 120 MoKa tube N KappaCCD 21256 25.0 0.047 4711 291 DENZO-SMN 0.053 0.105 0.993
o1332-o133Britton C8H6F4I2OS 480.0 Pnma 297 MoKa tube EN CAD-4 2820 26.0 0.065 1340 95 TEXSAN 0.103 0.125 0.999
o1334-o133Thamotharan C16H17NO2 255.3 P21/c 160 MoKa N FR591 t N KappaCCD 33348 30.0 0.047 3685 172 DENZO-SMN and 0.072 0.144 0.998
o1336-o133Burger C20H16Cl3O 441.7 P-1 153 MoKa tube Stoe IPDS 15762 26.0 0.070 7227 487 INTEGRATE in 0.095 0.127 0.927
o1339-o134Coruh C6H6N2S 138.2 P21/c 293 MoKa tube N KappaCCD 1849 25.5 0.060 1135 82 HKL DENZO and 0.077 0.154 1.000
o1342-o134Khan C17H17NSi 263.4 P21/c 1500.688 Synchrotr B AXS SMART 1K CC 21435 24.5 0.047 7939 514 SAINT 0.187 0.993
o1345-o134Ugur C18H26N4O2 394.6 P21/n 173 MoKa tube B SMART CCD 5476 26.4 0.028 1991 124 SAINT 0.034 0.090 0.988
o1347-o134Crockett C5H6N4O5 202.1 P21 298 MoKa tube Nicolet P3 4147 25.0 0.000 4147 505 RDNIC 0.147 0.247 0.787
o1349-o135Gilardi C4H4N4O4 172.1 P-1 153 MoKa tube B SMART CCD 4569 26.4 0.041 2785 235 SAINT 0.083 0.080 0.992
o1351-o135Harrison C6H15N2O3P 194.2 P212121 293 MoKa tube B SMART1000 CCD 6962 27.5 0.028 2139 110 SAINT 0.044 0.098 1.000
o1354-o135Coles C20H10BF15 642.2 P-1 150 MoKa BN FR591 B-N KappaCCD 21780 27.5 0.048 5282 389 DENZO and COL 0.043 0.096 0.992
o1357-o135Hansen C13H18O2 206.3 P21 298 MoKa tube EN CAD-4 3086 27.0 0.019 2910 416 XCAD4 0.079 0.105 1.000
o1359-o136Brodesser C8H15NO3 173.2 I41/a 123 MoKa tube N KappaCCD 13978 25.0 0.078 1792 112 HKL DENZO and 0.119 0.111 0.996
o1362-o136Kazak C14H12O3S 260.3 Pbca 293 MoKa tube EN CAD-4 2551 26.3 0.000 2551 211 XCAD4 0.160 0.112 0.996
o1364-o136Humphrey C14H10O4S2 306.3 C2/c 250 MoKa tube N KappaCCD 14048 27.5 0.058 4864 331 HKL DENZO and 0.122 0.137 0.989
o1367-o136Capuano C18H26N4O2 362.5 C2/c 123 MoKa tube KappaCCD 20806 27.5 0.041 4643 242 HKL DENZO and 0.065 0.092 0.995
o1370-o137Furneaux C12H22N2O6 290.3 P212121 173 MoKa tube S/Nicolet R3m 4C 1608 25.9 0.039 1504 187 SHELXTL 0.066 0.094 0.999
o1372-o137Bernes C25H36O5 416.5 P1 298 MoKa B P4 9296 25.0 0.031 7990 1082 XSCANS 0.094 0.191 0.997
o1376-o137Shi C34H28Cl2O 539.5 P-1 294 MoKa tube S P4 5121 25.0 0.015 4671 344 SHELXTL 0.055 0.088 0.991
o1379-o138Vembu C15H10N2O5 330.3 P21/c 120 MoKa Bede micr B Proteum M 18512 27.2 0.050 6011 475 SAINT 0.067 0.078 0.972
o1383-o138Vembu C13H14N4O5 306.3 P-1 120 MoKa tube B Proteum M 3781 25.0 0.037 2332 241 SAINT-NT 0.075 0.067 0.996
o1387-o138Vembu C12H7N3O9S 369.3 Pca21 120 MoKa tube B SMART CCD 6K 8989 27.1 0.033 2952 247 SAINT-NT 0.036 0.059 0.999
o1390-o139Vembu C12H8N2O7S 324.3 Pna21 120 MoKa tube B SMART CCD 6K 9331 27.1 0.059 2832 223 SAINT 0.046 0.070 1.000
o1393-o139Wu C19H18BrN3 416.3 P-1 296 MoKa R RAXIS-RAPID 17152 26.0 0.029 2788 253 CrystalStructure 0.130 0.986
o1395-o139Krishna C19H14O4 306.3 P21/c 293 MoKa tube S SMART 1K CCD 25479 33.2 0.031 10531 415 SAINT 0.122 0.167 0.923
o1398-o139Shao C25H31F3N2 464.5 P212121 213 MoKa tube B CCD 15557 28.3 0.055 3332 321 SAINT 0.050 0.125 0.980
o1400-o140Nandhini C14H19NO5S 313.4 C2/c 150 MoKa tube B SMART CCD 15899 25.0 0.021 3132 197 SAINT 0.037 0.100 0.996
o1403-o140Khera C30H50O 426.7 P21 170 MoKa tube B SMART CCD 15904 28.3 0.036 3278 427 SAINT 0.051 0.103 0.978
o1405-o140Li C26H18Cl2N 521.4 P21/n 293 MoKa tube B CCD 13265 26.5 0.037 4889 317 SAINT 0.085 0.107 0.993
o1407-o140Bendheif C5H12N5O6P 269.2 P21/c 293 MoKa tube N KappaCCD 10263 26.0 0.047 1978 170 DENZO and SCA 0.040 0.082 0.944
o1410-o141Kennedy C6H10N2O5 190.2 P21/c 150 MoKa tube N KappaCCD 5375 27.4 0.027 1894 158 DENZO and COL 0.053 0.088 0.996
o1413-o141Oku C20H28N2O5 376.5 P21 173 CuKa R RAXIS-RAPID 16496 65.5 0.055 1844 215 CrystalStructure 0.067 1.000
o1416-o141Li C34H32N4O5 608.7 P21/n 293 MoKa tube B SMART CCD 14013 26.4 0.042 6236 413 SAINT 0.114 0.137 0.996
o1418-o141Li C24H24N4O3 448.5 P-1 293 MoKa tube B SMART CCD 6236 26.4 0.022 4585 301 SAINT 0.084 0.113 0.986
o1420-o142Li C31H29ClN3 559.1 P21/c 293 MoKa tube B SMART CCD 14461 25.0 0.046 5070 370 B SAINT 0.125 0.155 0.981
o1423-o142Koysal C17H9N3O 271.3 P21/c 150 MoKa tube B SMART CCD 21956 28.7 0.031 6214 451 SAINT 0.075 0.115 0.906
o1425-o142Marx C11H11NO5 237.2 P21/c 173 MoKa tube S 1K CCD three-ci 17271 30.6 0.042 3064 159 SAINT 0.069 0.098 0.926
o1427-o142Lynch C15H17ClN2 292.8 P21/c 150 MoKa BN FR591 B-N KappaCCD 9261 25.0 0.277 2439 193 DENZO and COL 0.265 0.176 0.982
o1429-o143Bhaskaran C30H26N2O4 478.5 P21/n 293 MoKa tube CCD 30895 28.1 0.031 11480 653 SAINT 0.110 0.166 0.926
o1432-o143Aravindan C18H16ClNO 297.8 P-1 293 MoKa tube S SMART CCD 4703 25.0 0.015 3269 192 SAINT 0.060 0.130 0.916
E59 Part 10
i134-i136 Wu FeH4Mo2NO8 393.8 Pnma 293 MoKa tube R Weissenberg IP 932 27.5. 932 71 TEXSAN 0.024 0.055 1.000
i137-i138 Wu Cs4Ge2S8 933.4 C2/m 293 MoKa tube Phillips PW1100 4 4059 30.0 0.034 1417 41 REDU4 0.028 0.051 1.000
m830-m832 Yoshikawa C27H23ClF1 935.1 P-1 296 MoKa R RAXIS-RAPID IP 21482 30.5 0.069 7417 456 TEXSAN 0.156 30.500
m833-m835 Khan C62H106P4P 1365.5 P-1 150 MoKa B-N KappaCCD 26112 25.0 0.109 5684 309 HKL DENZO and SCALEP 0.172 0.980
m836-m837 Sobolev C4H14CoO8 249.1 P21/c 153 MoKa tube B AXS CCD 9443 37.5 0.018 2429 90 SAINT 0.021 0.047 0.990
m838-m840 Plakatouras C21H17F18O 896.3 P21/c 293 MoKa tube Mar Research IP S 9202 24.9 0.039 4785 555 XDS 0.042 0.086 0.817
m841-m842 Yang C14H18Co2N 556.2 P-1 298 MoKa tube B SMART APEX 4046 27.5 0.030 2084 169 SAINT 0.039 0.082 0.970
m843-m844 Zhu C24H22N4Ni 489.2 C2/c 293 MoKa tube B SMART CCD 19355 27.0 0.018 5137 299 SAINT 0.036 0.095 0.993
m845-m846 Chen C12H8CdCl2 363.5 C2/c 223 MoKa tube B APEX 5052 28.3 0.031 1403 78 SAINT 0.069 0.159 0.950
m847-m848 Amini C10H10F4O2 356.9 P212121 298 MoKa tube B APEX 10861 28.3 0.033 2931 156 SAINT 0.033 0.061 0.960
m849-m850 Yang C10H14Ni2O 475.6 P-1 298 MoKa tube EN CAD-4 2476 30.0 0.031 2300 136 XCAD4/PC 0.082 0.108 1.000
m852-m854 Nordell C39H48CoN8 831.8 P-1 294 MoKa tube B SMART APEX CCD 16276 26.4 0.024 8371 543 SAINT-Plus-NT 0.068 0.124 0.990
m855-m858 Ren C20H11FN5P 663.7 P-1 293 MoKa tube CCD 16959 25.0 0.049 11415 836 SAINT 0.074 0.135 0.985
m859-m860 Rao C9H9N1O6SZ 324.6 Pbca 298 MoKa tube B APEX CCD 12660 27.5 0.033 2597 199 SAINT 0.038 0.085 0.990
m861-m863 Song C38H34Fe2O 698.5 P-1 293 MoKa tube B P4 6839 27.0 0.000 6840 397 SHELXTL 0.042 0.099 1.000
m864-m866 Panosyan C17H23Cl2N 437.7 P1 150 MoKa tube N KappaCCD 7172 27.6 0.044 3959 227 DENZO-SMN 0.032 0.080 0.988
m867-m869 Song C18H48Co3N 881.4 P-1 293 MoKa tube S SMART CCD 4522 25.0 0.025 3009 259 XPREP in SHEL 0.067 0.127 0.991
m870-m872 Xu C18H38N2O8 529.2 C2/c 298 MoKa tube B APEX 8978 25.0 0.036 2234 133 SAINT 0.046 0.098 1.000
m873-m875 Xu C28H42N2O8 653.3 P21/n 298 MoKa tube B APEX 23125 25.0 0.039 5563 352 SAINT 0.081 0.166 1.000
m876-m877 Amini C16H28Cl8O 1138.7 P-1 298 MoKa tube B APEX 7696 28.3 0.037 3977 176 SAINT 0.079 0.129 0.910
m878-m879 Zhu C22H30ClCo 508.9 P21/n 298 MoKa tube B SMART CCD 12017 25.0 0.047 4049 289 SAINT 0.069 0.113 1.000
m880-m882 Fainerman-M C18H36AgNO 678.7 C2/m 150 MoKa tube B SMART 1000 CCD 12618 27.0 0.018 3180 181 SAINT and XPR 0.051 0.123 0.959
m883-m885 Muranishi C20H20FeN2 472.2 P21/n 296 MoKa R AFC5R 2623 27.5 0.025 2264 142 TEXSAN 0.111 1.000
m886-m888 Liu C12H16Cl2C 562.4 P21/c 295 MoKa tube B SMART CCD 13046 27.5 0.067 4872 262 SAINT 0.088 0.108 0.990
m889-m891 Albada C24H16CuN1 572.0 P21/c 173 MoKa tube N KappaCCD 20133 27.5 0.091 5330 352 COLLECT 0.102 0.128 0.992
m892-m893 Ito C6H9CoO3S6 380.5 P21/n 296 MoKa R AFC-5S 3550 27.5 0.013 2629 146 CrystalStructure (Mo 0.036 0.998
m894-m896 Zhang C30H44O10S 1039.4 P-1 298 MoKa tube S P4 4C 3983 25.0 0.032 3287 205 REDUCE in XSC 0.071 0.078 1.000
m897-m899 Okabe C22H20FeN2 464.3 P21/c 296 MoKa R AFC5R 2641 27.5 0.024 2301 143 TEXSAN Version 1.11 0.141 1.000
m900-m902 Ma C56H72N8Ni 1390.6 P-1 293 MoKa tube S P4 7676 25.0 0.022 6365 469 XSCANS 0.110 0.143 0.987
m903-m905 Abul-Haj C10H12CuN1 495.8 Pbca 293 MoKa tube STOE STADI4 4C 3096 32.5 0.000 3096 149 X-RED 0.080 0.166 1.000
m906-m907 Zhu C2H8AgAsF6 356.9 Pnma 293 MoKa tube CCD 3748 26.5 0.033 949 62 SAINT 0.055 0.135 0.993
m908-m910 Wang C12H16MnN4 431.2 C2/c 293 MoKa tube Make Model CCD 2675 25.0 0.045 1585 139 XPREP in SHELXTL 0.131 0.988
m911-m913 Gibson C31.50H28N 1205.2 P21/c 110 MoKa tube SMART APEX CCD 29838 28.3 0.042 7989 457 SAINT 0.032 0.076 0.930
m914-m915 Zeller C7H5FeIO2 303.9 P21/c 100 MoKa tube B AXS SMART APEX 17192 28.3 0.025 4207 229 SAINT-Plus 0.027 0.059 0.997
m916-m918 Deschamps C18H31Cl2C 561.4 P-1 103 MoKa tube B SMART 1000 CCD 12393 29.0 0.025 5700 300 SAINT XPREP 0.041 0.098 0.903
m919-m920 Zhang C32H36Cl6C 1047.6 P-1 298 MoKa tube R R-AXIS-RAPID 19494 27.5 0.034 9365 467 CrystalStruct 0.079 0.185 0.990
m921-m923 Yang C20H34O32Z 1113.3 P21/n 298 MoKa tube B APEX CCD 16789 25.0 0.048 3105 259 SAINT 0.063 0.129 1.000
m924-m925 Zhu C12H44Cl2N 590.1 P-1 293 MoKa tube B SMART-CCD 3644 25.0 0.020 2418 204 SAINT 0.034 0.089 0.983
m926-m928 Zhou C7.50H10.7 327.8 C2/c 293 MoKa tube S SMART CCD 3823 25.0 0.021 2059 185 SAINT 0.060 0.154 0.994
m929-m930 Hubener C4H10AlCl3 207.5 P21/n 100 MoKa tube STOE IPDS II 2C 17320 27.8 0.088 2224 83 X-AREA 0.046 0.110 0.975
m931-m933 Crocock C19H15CrMn 430.3 P21/c 298 MoKa tube Nicolet P3 3422 25.1 0.075 3167 236 RDNIC 0.079 0.099 0.995
m934-m935 Bostrom C12H36AlCl 602.1 R-3 150 MoKa N KappaCCD 2680 30.0 0.012 1340 44 HKL DENZO and 0.027 0.068 0.998
m936-m938 Okabe C18H16N2O4 430.8 P21/n 296 MoKa R AFC-5R 4127 27.5 0.042 3760 226 TEXSAN 0.071 1.000
m939-m941 Niedwieski C18H38Cl2N 436.3 C2/c 173 MoKa KappaCCD 8029 27.5 0.056 2597 114 HKL DENZO and 0.073 0.137 0.999
m942-m943 Zhu C17H30Ag2N 572.2 P-1 293 MoKa tube S SMART CCD 4537 26.0 0.015 3814 245 SAINT 0.042 0.093 0.969
m944-m946 Xue C18H20CoN4 447.3 P-1 295 MoKa tube R RAXIS-RAPID 4322 27.5 0.015 2074 133 CrystalStruct 0.030 0.067 0.990
m947-m949 Jiang C10H18N2O7 343.7 P-1 298 MoKa tube B SMART CCD 4279 25.0 0.013 3078 215 SMART 0.034 0.068 0.880
m950-m952 Lutz C19H21N3Ni 398.1 P21/c 150 MoKa RA N KappaCCD 36002 27.5 0.057 4132 249 HKL2000 and S 0.040 0.080 0.998
m953-m954 Green C12H24Cl2F 615.4 P-1 175 MoKa tube B SMART 1K Platfo 11893 28.2 0.021 5333 265 SAINT 0.033 0.065 0.980
m955-m956 Mizuguchi C34H54O8Zn 656.2 C12/c1 93 CuKa R RAXIS-RAPID IP 16078 68.2 0.040 3054 193 TEXSAN 0.126 0.925
m957-m958 Sui-Seng C14H18Cl2N 391.6 P42/n 293 CuKa tube EN CAD-4 18272 69.9 0.095 1503 88 local program 0.052 0.137 1.001
o1435-o143Sivalakshmi C9H12ClF2N 299.7 P212121 298 CuKa tube R AFC-7S 2540 67.9 0.028 2082 191 TEXSAN 0.060 0.963
o1438-o144Govind C23H24N2O3 376.4 P-1 293 MoKa tube CCD 6064 28.0 0.012 4209 253 SAINT 0.059 0.141 0.913
o1441-o144Akutsu C15H20NO5S 454.6 P-1 296 MoKa Rigaku RA R AFC-7R 4709 27.5 0.028 2479 235 TEXSAN for Wi 0.067 0.042 0.999
o1444-o144Haddad C5H10BrN3O 208.1 P-1 295 MoKa tube S P2~1~ upgraded 1781 25.0 0.031 1412 99 XSCANS 0.042 0.100 0.991
o1446-o144Li C24H27NO4 393.5 Pca21 296 MoKa tube S P4 8775 27.0 0.031 4854 531 SHELXTL 0.135 0.090 1.000
o1448-o145Stibrany C20H22N4O2 350.4 C2221 296 MoKa tube B CCD 3653 25.1 0.032 1607 140 SAINT 0.071 0.120 0.993
o1451-o145Zou C23H30I2N4 632.3 P-1 293 MoKa tube B SMART CCD 6446 25.0 0.059 4417 276 SAINT 0.122 0.184 0.993
o1453-o145Mizuguchi C24H18Cl6N 603.2 P21/c 93 CuKa R RAXIS-RAPID IP 11504 68.2 0.074 2235 163 TEXSAN 0.118 0.950
o1455-o145Smith C11H18IN7O 487.3 P21/a 295 MoKa Rigaku RA R AFC7R 4344 27.5 0.022 4057 275 TeXsan for Wi 0.041 0.095 0.999
o1458-o146Seshadri C29H25N3O3 463.5 P-1 293 MoKa tube CCD 7283 28.0 0.016 5057 316 SAINT 0.060 0.155 0.917
o1461-o146Chen C13H11N3S 241.3 Iba2 296 MoKa tube S P4 1561 27.0 0.011 1317 155 SHELXTL 0.039 0.070 1.000
o1464-o146Sonar C12H13NOS 219.3 P21/n 173 MoKa tube N KappaCCD 7996 27.5 0.042 2452 143 DENZO-SMN 0.068 0.122 1.000
o1467-o146Li C23H20N4O4 448.5 P-1 293 MoKa tube CCD 14787 26.5 0.019 4388 290 SAINT 0.042 0.107 0.994
o1469-o147Li C10H12O3 180.2 P21/c 298 MoKa tube B APEX 5370 25.0 0.021 2078 125 SAINT 0.058 0.155 0.930
o1471-o147Cao C21H28F3N3 491.5 P21 296 MoKa tube S P4 6316 29.0 0.014 3269 327 SHELXTL 0.044 0.085 1.000
o1474-o147Zhuang C22H18ClNO 379.8 Cc 292 MoKa tube S P4 3465 25.0 0.020 2449 253 SHELXTL 0.035 0.086 1.000
o1476-o147Ohba C29H40O7 500.6 P212121 297 MoKa R AFC7R 4059 27.5 0.016 3419 326 TEXSAN 0.126 1.000
o1478-o148Sonar C23H22N2O 342.4 P-1 173 MoKa tube N KappaCCD 6198 25.0 0.041 3118 236 DENZO-SMN 0.089 0.121 1.000
o1481-o148Isik C17H12N2O 260.3 P21/a 293 MoKa tube STOE IPDS 2 3702 29.6 0.000 3702 186 X-RED 0.093 0.128 0.994
o1483-o148Bats C2H5NO 59.1 Pccn 146 MoKa tube S SMART 1K CCD 12606 28.5 0.074 1767 91 SAINT 0.109 0.116 0.973
o1486-o148Doi C12H13NO3 219.2 P21 120 MoKa MacScienc B SMART APEX CCD 4798 27.9 0.024 1385 146 SAINT-Plus 0.045 0.118 0.976
o1488-o148Ding C19H18N2O2 306.4 P212121 273 MoKa tube B SMART CCD 7934 27.0 0.026 3508 210 SAINT 0.055 0.098 0.999
o1490-o149Mizuguchi C30H32N2O2 452.6 P-1 296 CuKa R RAXIS-RAPID IP 4848 68.0 0.097 1759 154 TEXSAN 0.209 0.875
o1493-o149Mizuguchi C18H24N2O4 332.4 P-1 93 CuKa R RAXIS-RAPID IP 3858 68.2 0.038 1421 112 TEXSAN 0.117 0.910
o1496-o149Zhang C13H11BrN2 291.2 P-1 298 MoKa tube S P4 4C 2912 25.0 0.030 2069 155 REDUCE in XSC 0.080 0.108 0.970
o1498-o150Korendovych C28H24N2O2 420.5 P21212 173 MoKa tube B SMART CCD 7362 25.0 0.041 1605 150 SAINT 0.046 0.117 0.969
o1501-o150Shi C20H22FNO4 359.4 P-1 296 MoKa tube S P4 3694 25.0 0.008 3316 247 SHELXTL 0.061 0.114 1.000
o1503-o150Napolitano C14H13NO4 259.3 P21/c 120 MoKa KappaCCD 5117 27.5 0.013 2672 207 HKL Denzo and Scalep 0.104 0.996
o1506-o150Napolitano C13H10O5 246.2 P21/c 120 MoKa KappaCCD 4114 27.5 0.023 2450 197 HKL Denzo and Scalep 0.124 0.996
o1509-o151Dupont C10H11N3O4 301.3 P21/n 293 CuKa tube Stoe-S AED 4C 2498 67.9 0.044 2317 178 REDU4 0.059 0.156 0.979
o1512-o151Velde C27H24O2S 412.5 P-1 293 MoKa tube EN Mach3 4949 27.0 0.018 4635 329 XCAD4 0.075 0.113 0.995
o1514-o151Gainsford C20H28Cl2O 451.3 P21 153 MoKa tube S/Nicolet R3m 4C 4099 24.7 0.061 3955 503 R3M Software 0.110 0.169 0.997
o1517-o151Wang C14.75H15O 332.3 P-1 298 MoKa tube B APEX 14782 25.0 0.052 9473 873 SAINT 0.163 0.196 0.927
o1519-o152Solomon C32H40O9 568.6 P212121 293 MoKa tube B SMART CCD 22610 26.0 0.031 3243 371 SAINT 0.053 0.132 0.998
o1522-o152Herrera C10H10O3 178.2 P21/c 296 MoKa B P4 5486 25.0 0.023 3231 255 XSCAnS 2.21 0.098 0.151 0.999
o1525-o152Gadepalli C21H31O5.5 371.5 P1 100 MoKa tube N KappaCCD 21194 27.5 0.031 4338 507 DENZO and SCA 0.054 0.089 0.984
o1528-o152Atalay C24H22N4O3 414.5 P21/c 293 MoKa tube Stoe IPDS-2 3749 25.0 0.134 3749 336 X-RED 0.077 0.097 0.991
o1530-o153Mizuguchi C15H22O3 250.3 P-1 93 CuKa R R-AXIS RAPID IP 13032 68.3 0.037 4766 337 TEXSAN 0.104 0.901
o1532-o153Soylu C15H13ClN2 304.7 P21/n 293 MoKa STOE IPDS 2 13425 25.0 0.058 2518 199 X-RED 0.051 0.078 0.998
o1535-o153Isik C25H25N4O3 430.5 P21/n 293 MoKa Stoe IPDS 2 6461 29.6 0.000 6461 298 X-RED 0.118 0.224 0.994
o1538-o154Nandhini C25H25NO 355.5 P21/c 105 MoKa tube B SMART 22265 26.8 0.037 4231 250 SAINT 0.052 0.128 0.998
o1541-o154ozcan C5H10O3S2 182.3 P21/c 293 MoKa tube S P4 1666 26.0 0.044 1161 112 SHELXTL97 0.048 0.129 1.000
o1544-o154Bray C30H30O3 438.5 Pna21 150 MoKa tube S SMART 1000 CCD 46026 25.0 0.026 6036 601 SAINT and XPR 0.040 0.094 0.983
o1546-o154Kooijman C14H25N7O2 323.4 C2/c 150 MoKa RA EN CAD-4 Turbo 10715 25.3 0.284 3141 205 HELENA 0.230 0.187 1.000
o1549-o155Vasu C13H11NO4 245.2 P21/c 293 MoKa tube B SMART CCD 8371 25.0 0.013 2328 207 SAINT 0.052 0.138 0.955
o1551-o155Blann C7H10O5 174.2 P31 293 MoKa tube B SMART 1K CCD 4357 28.3 0.071 1009 121 SAINT-Plus an 0.088 0.067 0.999
o1554-o155Argay C14H19BF2O 284.1 P-1 293 MoKa tube EN CAD-4 6462 35.0 0.011 5947 182 XCAD4 0.089 0.170 1.000
o1556-o155Aramaki C36H22N4 510.6 P21/n 93 CuKa R R-AXIS RAPID IP 10724 68.2 0.111 2013 184 TEXSAN 0.066 0.924
o1559-o156Seshadri C29H22N2O4 462.5 P21/c 293 MoKa tube B SMART CCD 14121 28.0 0.030 5281 316 SAINT 0.093 0.171 0.960
o1562-o156Shi C20H17FN2 304.4 P21/n 291 MoKa tube S P4 3487 25.5 0.009 3005 209 SHELXTL 0.087 0.091 1.000
o1564-o156Aravindan C24H19ClN2 386.9 P-1 293 MoKa tube S SMART CCD 5918 28.0 0.017 4119 274 SAINT 0.063 0.141 0.899
o1567-o156Bhaskaran C38H36N2O2 680.9 P-1 293 MoKa tube EN CAD-4 6283 25.0 0.023 5919 415 XCAD4 0.092 0.126 1.000
o1570-o157Vrabel C18H17N3O6 371.4 P-1 293 MoKa tube Syntex P2~1~ 4128 28.0 0.000 4128 248 XP21 0.215 0.083 0.983
o1572-o157Usha C38H37NO4 571.7 P212121 293 MoKa tube S SMART CCD 42360 28.3 0.037 8348 775 SAINT 0.069 0.137 0.994
o1575-o157Silva C16H20O5 292.3 C2/c 120 MoKa N KappaCCD 5170 25.0 0.016 2666 271 HKL SCALEPACK and DE 0.090 0.997
o1578-o158Hu C23H27NO4S 413.5 P-1 293 MoKa tube B SMART APEX CCD 5318 25.0 0.017 3680 265 SAINT 0.053 0.115 0.980
o1581-o158Oku C16H30N2O5 330.4 P212121 173 CuKa R R-AXIS RAPID 105756 68.3 0.056 5906 552 CrystalStructure 0.159 0.996
o1584-o158Hu C9H24Cl2N2 263.2 Pbca 173 MoKa tube R/ADSC CCD 27028 27.9 0.058 3286 173 d*TREK 0.055 0.081 0.930
o1586-o158Du C17H28BrNO 342.3 P212121 293 MoKa B SMART 1000 6633 25.0 0.100 3211 186 SAINT 0.133 0.122 0.990
E59 Part 11
i139-i141 Sandstrom CaK2O7P2 292.2 P21/n 293 MoKa N KappaCCD 31100 30.0 0.072 2038 110 DENZO and SCA 0.027 0.067 0.999
i142-i144 Meyer Br6H12N4Sc 637.5 P-1 293 MoKa tube Stoe IPDS II 6953 26.0 0.077 2938 111 X-AREA 0.118 0.081 0.998
i145-i146 Meyer Br6H6N2Sc2 603.5 P-1 293 MoKa tube Stoe IPDS II 9270 29.6 0.072 3470 93 X-AREA 0.095 0.096 0.988
i147-i148 Condron Al43Gd6Ta4 2827.4 P63/mcm 293 MoKa tube B SMART APEX 11039 28.2 0.036 873 53 SAINT 0.020 0.043 0.985
i149-i150 Eriksson Ce2K5NaO24 1075.1 C2/m 173 MoKa tube S SMART 1K CCD 9019 32.0 0.032 1998 95 SAINT and SAD 0.024 0.051 0.954
i151-i153 Bostrom H2NaO13Rb3 693.2 Pnma 150 MoKa N KappaCCD 24175 30.0 0.083 2271 107 HKL DENZO and 0.038 0.077 0.994
i154-i155 Alig H22Cl4CrN6 355.0 P212121 173 MoKa tube S CCD three-circl 14937 27.1 0.062 2941 194 SAINT 0.061 0.073 0.932
m959-m960 Lee C5H14AsNO4 227.1 P21 293 MoKa tube B SMART1000 CCD 5328 32.5 0.014 3187 101 SAINT 0.020 0.042 0.998
m961-m963 Yang C12H16CoN2 375.2 Immm 298 MoKa tube B APEX 2970 27.5 0.053 480 47 SAINT 0.097 0.297 0.990
m964-m966 Xiao C36H32Cl2C 958.7 P-1 293 MoKa tube B SMART CCD 5614 26.5 0.086 4022 308 SAINT 0.062 0.124 0.977
m967-m969 Atria C10H10Cl4C 459.1 P21/c 293 MoKa tube B Smart APEX CCD 5290 25.0 0.034 1664 92 SAINT-NT 0.041 0.087 0.947
m970-m971 Herdtweck C9H12Br2N4 442.5 P21/n 293 MoKa N FR 591 N \k-CCD 23418 25.3 0.060 2422 147 DENZO 0.040 0.095 1.000
m972-m974 Yoshikawa C24H16Cl2F 768.5 C2/c 200 MoKa R RAXIS-RAPID IP 11793 27.5 0.061 2675 206 teXsan 0.091 27.480
m975-m976 Zeller C9H6CrFNO3 247.2 Pnma 298 MoKa tube B SMART APEX CCD 7436 28.2 0.019 1185 91 SAINT-Plus 0.027 0.077 0.959
m977-m979 Wu C34H34N2Ni 593.3 C2 295 MoKa tube S P4 7965 28.3 0.014 7242 376 SHELXTL 0.068 0.100 1.000
m980-m981 Han C24H32MnN1 579.7 C2/c 293 MoKa tube B SMART CCD 7826 25.0 0.041 2899 172 SAINT 0.078 0.103 0.984
m982-m984 Yang C24H18Cl4M 591.2 Pbcn 294 MoKa tube S SMART CCD 16055 27.6 0.039 2924 159 SHELXTL-NT 0.055 0.105 0.999
m985-m987 Bucar C30H30N4Ni 569.3 P21/n 100 MoKa tube Oxford Xcalibur C 12114 30.1 0.063 3904 186 CrysAlis RED 0.059 0.116 0.989
m988-m990 Alcantara-F C15H26Cl2N 370.7 P43212 296 MoKa B P4 6151 25.0 0.036 1467 93 XSCANS 0.047 0.065 1.000
m991-m993 Akitsu C6H20Cl2Cu 410.7 P21/a 297 MoKa R AFC-7R 2072 27.5 0.008 1538 98 TEXSAN 0.068 1.000
m994-m996 Baggio C16H23DyO2 713.8 P21/n 297 MoKa tube B SMART APEX CCD 19843 25.0 0.030 5363 423 SAINT-NT 0.034 0.072 0.924
m997-m999 Charmant C30H26I8N6 1629.3 P21/n 173 MoKa tube S SMART CCD 13744 27.5 0.049 5038 234 SHELXTL 0.086 0.079 0.994
m1000-m100Charmant C30H26Bi2I 1903.7 P21/n 173 MoKa tube S SMART CCD 10596 24.0. 10596 255 SHELXTL 0.094 0.212 0.997
m1002-m100Jia C34H30Cl2C 660.4 C2/c 293 MoKa tube Make Model CCD 9098 26.4 0.048 3308 196 SAINT and SHE 0.105 0.121 0.998
m1004-m100Crane C11H9Cl2F6 412.9 P21/c 150 MoKa tube Stoe IPDS-II 25607 32.3 0.031 4814 191 X-RED 0.056 0.109 0.993
m1006-m100Chohan C25H20NO2S 744.7 P-1 291 MoKa tube B SMART 1000 CCD 15605 32.5 0.021 10417 334 SAINT 0.073 0.072 0.958
m1010-m101Lin C6H8Na2O10 351.5 Pbca 295 MoKa tube R R-AXIS RAPID 8878 27.4 0.021 1206 88 CrystalStruct 0.026 0.056 1.000
m1013-m101Smith C40H36Cu2I 1083.5 P21/c 293 MoKa tube Stoe IPDS 17645 25.9 0.031 4082 246 IPDS 0.032 0.066 0.987
m1015-m101Gott C32.50H38C 810.0 P-1 150 MoKa tube N KappaCCD 34198 26.0 0.088 6960 406 DENZO-SMN 0.067 0.105 0.992
m1018-m101ozturk C6H4GeN2O2 272.9 Pnnm 293 MoKa tube S SMART CCD 6631 28.3 0.022 1469 67 SAINT 0.046 0.101 0.936
m1020-m102Zhu C12H44FeN1 640.4 P-1 298 MoKa tube S SMART CCD 3689 25.0 0.015 2436 266 SAINT 0.045 0.117 0.985
m1022-m102Richards-Jo C16H40.50C 831.6 P21/c 150 MoKa tube N KappaCCD 60586 27.5 0.034 13750 798 DENZO-SMN 0.044 0.082 0.997
m1025-m102You C20H20N2O2 385.8 C2 293 MoKa tube S SMART CCD 9558 25.0 0.056 6279 451 SAINT 0.099 0.159 0.998
m1028-m103Zhu C24H20CdF2 578.8 P21/n 298 MoKa tube B SMART CCD 12213 25.0 0.027 4208 316 SAINT 0.041 0.064 0.998
m1031-m103Jones C17H44Cl2N 529.9 P212121 180 MoKa tube N Kappa CCD 14487 27.5 0.046 5324 243 HKL DENZO and 0.047 0.075 0.979
m1035-m103Green C22H26F12N 1035.6 P21/c 150 MoKa tube SMART6000 CCD 23878 28.3 0.047 4387 250 SAINT 0.047 0.057 1.000
m1038-m104You C32H46ClCo 677.1 P-1 298 MoKa tube B SMART CCD 4017 25.0 0.045 2732 200 SAINT 0.101 0.149 0.973
m1013-m101Simith C40H36Cu2I 1083.5 P21/c 293 MoKa tube Stoe IPDS 17645 25.9 0.031 4082 246 IPDS 0.032 0.066 0.987
m1044-m104Xu C90H80Cl6C 1837.3 P21/n 298 MoKa tube B SMART CCD 18343 25.0 0.084 7801 578 SHELXTL 0.136 0.136 0.996
m1046-m104Zhu C9H11AgF3N 456.2 P-1 293 MoKa tube S SMART CCD 6831 26.0 0.025 5758 425 SAINT 0.077 0.122 0.968
m1048-m104Zhu C4H12AgAsF 385.0 P21/n 293 MoKa tube S SMART CCD 4479 26.0 0.030 2025 135 SAINT 0.047 0.117 0.942
m1050-m105Paz C36H65NaO1 728.9 P212121 180 MoKa tube N KappaCCD 14637 27.5 0.048 4873 472 HKL DENZO and 0.077 0.168 0.983
m1053-m105Jin C13H16CoN6 395.3 P21/c 296 MoKa tube S P4 3099 25.0 0.012 2890 230 SHELXTL 0.045 0.095 1.000
m1056-m105Rabe C56H64N4P2 1026.0 P-1 198 MoKa tube S B P4 1K CCD 7167 25.0 0.025 4422 299 SAINT 0.044 0.110 0.961
m1059-m106Goreshnik C10H36Al2F 520.4 P21/n 293 MoKa tube S AED2 2955 30.0 0.000 2955 148 X-RED 0.164 0.151 1.000
m1062-m106Liddle C29H42Cs2N 808.5 Cm 160 MoKa tube B SMART 1K CCD 7390 26.0 0.025 3879 201 SAINT 0.042 0.065 0.940
m1065-m106Sui-Seng C14H18Cl2N 391.6 P21/n 293 MoKa Tube S P4 7236 28.0 0.039 1886 90 XSCANS 0.034 0.084 1.000
m1067-m106Paz C36H72N4S8 948.2 P21/c 180 MoKa tube N KappaCCD 30156 27.5 0.037 11123 409 HKL DENZO and 0.097 0.196 0.991
m1070-m107Oblezov C7H22Cl2N4 307.9 P21/n 173 MoKa tube B SMART 1K CCD 7715 27.5 0.089 2944 136 SAINT 0.035 0.090 0.961
m1072-m107Shiu C7H15NNiO1 331.9 P-1 296 MoKa tube B SMART-CCD 6432 25.7 0.036 2857 172 SAINT 0.051 0.054 0.960
m1075-m107Atria C16H24Cl2C 462.9 P4nc 293 MoKa tube B SMART CCD 3889 25.0 0.072 896 64 SAINT-NT 0.062 0.085 0.998
m1078-m107Zeller C12H12CrO6 304.2 R3c 100 MoKa tube B AXS SMART APEX 5069 28.4 0.032 1040 64 SAINT-Plus 0.026 0.069 0.998
m1080-m108Fischer C6H9Na3O9 294.1 C2/c 299 MoKa tube B-N KappaCCD 8459 27.5 0.055 2451 178 DENZO and SCA 0.079 0.093 0.993
m1083-m108Wu C11H18F3Fe 547.4 Pnma 168 MoKa tube B SMART CCD 26787 26.4 0.059 2157 169 SAINT and Xta 0.067 0.094 0.990
o1589-o159Fusi C7H12N6O3 228.2 P212121 293 MoKa tube S P4 3578 30.0 0.032 1789 182 XSCANS 0.099 0.124 1.000
o1592-o159Cao C32H23Cl2N 492.4 P2~1~/c 293 MoKa tube B SMART CCD 14866 26.5 0.071 5355 316 SAINT 0.158 0.123 0.994
o1594-o159Shi C23H16ClN3 369.8 P21/c 291 MoKa tube S P4 7325 25.0 0.011 6330 490 SHELXTL 0.098 0.087 1.000
o1596-o159Zhong C11H12N4OS 248.3 P212121 298 MoKa tube B APEX 7255 27.5 0.021 2724 170 SAINT 0.049 0.089 0.980
o1599-o160Zhong C7H6N2S2 182.3 P21/c 298 MoKa tube B APEX 9371 27.5 0.046 3531 223 SAINT 0.091 0.125 0.960
o1601-o160Ariya C6H21Br3N4 389.0 P213 100 MoKa tube KappaCCD 14942 35.5 0.042 1335 40 Denzo and Sca 0.067 0.145 0.998
o1604-o160Ersanli C11H11NO3S 237.3 P21/c 293 MoKa tube R AFC-7S 3383 30.0 0.040 3176 146 TEXSAN for Wi 0.073 0.126 1.000
o1607-o160Hokelek C20H27N2O3 351.4 C2/c 293 MoKa tube EN CAD-4 3856 26.0 0.022 3163 242 XCAD4 0.120 0.169 1.000
o1610-o161Yufit C9H12O4 184.2 P21/n 120 MoKa Bede Micr B APEX CCD 7793 29.0 0.026 2315 166 SAINT 0.041 0.096 0.991
o1613-o161Kocaokutgen C14H13ClN2 260.7 P21/c 213 MoKa tube B AXS SMART CCD 5900 25.0 0.036 2206 215 SAINT 0.051 0.109 0.999
o1616-o161Karakurt C17H14N4O2 306.3 C2/c 293 MoKa tube STOE IPDS 2 4262 25.0 0.072 2700 265 X-RED 0.051 0.096 0.999
o1618-o162Li C39H34Cl2N 741.7 P21/c 293 MoKa tube B Model CCD 30794 26.4 0.072 14902 1016 SAINT 0.169 0.170 0.991
o1621-o162Zheng C17H19NO3 285.3 P212121 293 MoKa tube CCD 5521 25.0 0.066 1498 192 SAINT and SHE 0.104 0.119 0.987
o1624-o162Li C23H21ClN4 453.0 C2/c 293 MoKa tube B CCD 17147 26.4 0.054 4454 275 SAINT 0.101 0.170 0.998
o1626-o162Li C37.50H31C 845.8 P-1 293 MoKa tube B SMART CCD 10073 25.0 0.019 6824 480 SAINT 0.105 0.232 0.994
o1628-o163Martinez-Ma C24H19N3O3 429.5 P-1 293 MoKa B SMART 11581 27.5 0.035 4674 280 SAINT 0.113 0.150 0.991
o1631-o163Harris C34H51ClF4 715.2 P3121 170 MoKa tube CCD -I k 59064 27.0 0.058 7130 331 SAINT and SHE 0.052 0.099 1.000
o1634-o163Patrick C17H16O6 316.3 P21/c 293 MoKa tube Syntex P21 2035 22.5 1878 208 Xtal3.5 0.059 0.054 1.000
o1636-o163Hu C21H25NO2S 355.5 P-1 293 MoKa tube B P4 3583 25.0 0.041 3330 226 SHELXTL 0.122 0.160 0.998
o1638-o163Li C34H24Cl4N 650.4 P-1 293 MoKa tube B SMART CCD 12694 26.5 0.022 6118 388 SAINT 0.067 0.108 0.998
o1640-o164Li C33H22Cl4N 636.3 P21/n 293 MoKa tube B SMART CCD 24667 26.4 0.037 6135 379 SAINT 0.086 0.108 0.996
o1642-o164Gdaniec C7H2F5N1O1 211.1 P21/c 120 MoKa tube 4010 26.4 0.016 1517 135 CrysAlis RED 0.040 0.090 0.998
o1645-o164Du C6H5NO3 139.1 P21/c 293 MoKa B SMART 1000 3805 28.0 0.053 1397 91 SAINT 0.049 0.136 0.999
o1648-o164Olmstead C5H10N2O2 130.2 P-4n2 130 CuKa tube Syntex P21 777 66.8 0.022 598 63 XDISK 0.029 0.078 1.000
o1650-o165Rademeyer C24H37NO7 451.6 P-1 120 MoKa tube Oxford Excalibur2 12422 25.0 0.021 7546 289 CrysAlis RED 0.052 0.124 0.885
o1653-o165Zeller C10H8N2 156.2 P21/c 100 MoKa tube B AXS SMART APEX 4084 28.3 0.044 1069 71 SAINT-Plus 0.061 0.131 0.997
o1655-o165Zeller C12H12N2 184.2 C2/c 100 MoKa tube B AXS SMART APEX 4935 28.3 0.080 1257 69 SAINT-Plus 0.048 0.131 0.997
o1657-o165Low C18H18ClN3 311.8 P21/c 120 MoKa tube N KappaCCD 22681 25.0 0.097 3431 220 DENZO-SMN 0.112 0.128 0.987
o1659-o166Li C36H29Cl2N 622.5 P21/n 293 MoKa tube B SMART CCD 16632 26.4 0.059 6082 398 SAINT 0.131 0.126 0.995
o1661-o166Shi C24H20ClN3 385.9 P21/c 296 MoKa tube S P4 4393 25.5 0.012 3833 260 SHELXTL 0.075 0.109 1.000
o1663-o166Jian C17H17N5O2 355.4 P21/c 293 MoKa tube Oxford Instrument 5553 25.9 0.031 3257 227 PLEASE PROVID 0.083 0.125 0.995
o1666-o166Girija C9H8ClNO2 197.6 P21/c 293 MoKa tube B SMART CCD 7478 25.0 0.022 2116 140 SAINT 0.048 0.125 0.968
o1668-o166Li C17H17N 235.3 Pbca 293 MoKa tube B SMART CCD 14985 26.4 0.065 2843 163 SAINT and SHE 0.098 0.143 0.998
o1670-o167Fun C18H11ClO2 294.7 P21/c 293 MoKa tube S SMART CCD 6465 25.0 0.015 2312 234 SAINT 0.038 0.104 0.994
o1672-o167Nandhini C20H21NO3 323.4 P21/c 150 MoKa tube B SMART CCD 31988 28.3 0.037 8517 463 SAINT 0.087 0.183 0.990
o1675-o167Lough C21H24N2O2 336.4 P-1 150 MoKa tube N KappaCCD 20141 25.0 0.100 8463 456 DENZO-SMN 0.164 0.180 0.981
o1677-o167Aravindan C23H22O2S2 394.5 P-1 293 MoKa tube EN FR590 6133 30.0 0.023 5832 245 XCAD4 0.116 0.127 0.996
o1680-o168Govind C31H28N2O3 476.6 P21/c 293 MoKa tube CCD 14792 25.0 0.036 5701 327 SAINT 0.127 0.186 0.896
o1682-o168Choudhary C24H44N2 360.6 P21 293 MoKa tube Siemmens SMART CC 7516 27.5 0.021 2766 238 SAINT 0.069 0.159 0.996
o1685-o168Tam C18H18O3 282.3 Pccn 150 MoKa tube N KappaCCD 27619 27.5 0.057 3398 191 DENZO-SMN 0.063 0.113 0.997
o1687-o168Jordan C20H22O4 326.4 P21 150 MoKa tube N KappaCCD 5502 25.0 0.080 1647 220 DENZO-SMN 0.080 0.142 0.995
o1689-o169Shi C17H18N2O 266.3 P21/n 295 MoKa tube S P4 3202 25.5 0.024 2706 189 SHELXTL 0.077 0.119 1.000
o1691-o169Bolte C72H72Br8O 1736.6 P21/n 293 MoKa tube Stoe IPDS-II 2C 56958 25.4 0.109 6572 406 X-AREA 0.070 0.111 0.993
o1694-o169Fun C32H48Cl6O 773.4 P212121 293 MoKa tube S SMART CCD 18659 25.0 0.044 6626 422 SAINT 0.113 0.227 0.991
o1697-o169Geng C11H13ClN4 300.7 P21/c 293 MoKa tube B SMART APEX CCD 6812 25.0 0.062 2345 185 SAINT 0.061 0.118 0.997
o1700-o170Nicholson C18F15OP 548.2 P21/c 83 MoKa tube S SMART CCD 14186 26.4 0.034 7300 631 SAINT 0.066 0.096 0.997
o1702-o170Gott C27H33N3O6 591.7 P-1 150 MoKa tube N KappaCCD 29674 27.5 0.127 6402 356 DENZO-SMN 0.085 0.134 0.994
o1704-o170Xuan C16H20N2O5 320.3 P21/c 293 MoKa R RAXIS-RAPID 7122 27.5 0.028 3666 289 Crystalstructure 0.137 1.000
o1707-o170Xuan C4H12N2O5S 200.2 P21ab 293 MoKa R R-AXIS RAPID 8161 27.4 0.019 1968 146 CrystalStructure 0.082 0.998
o1710-o171Xuan C8H7ClO3 186.6 P21/c 293 MoKa R R-AXIS RAPID 3309 27.3 0.026 1755 138 CrystalStructure 0.098 0.995
o1712-o171Cooper C15H24N4O7 372.4 P21 190 MoKa N KappaCCD 3754 26.1 0.020 2204 244 DENZO/SCALEPA 0.054 0.106 0.974
o1715-o171Ryttersgaar C21H27N2O5 387.5 C2 122 CuKa tube EN CAD-4 3940 0.000 3940 361 DREADD 0.030
o1717-o171Moreno-Fuqu C10H6N2O4 218.2 C2/c 293 MoKa tube EN CAD-4 870 25.0 0.017 824 76 CAD-4 SDP 0.034 0.085 0.990
o1719-o172Hunter C38H40P2 558.6 P-1 100 MoKa tube B AXS SMART APEX 16351 28.3 0.021 7697 521 SAINT-Plus 0.039 0.104 0.994
o1721-o172Zeller C30H32P2 454.5 P21/c 90 MoKa tube B AXS SMART APEX 12864 28.3 0.046 3137 147 SAINT-Plus 0.047 0.123 0.998
o1723-o172Shan C15H13ClN4 380.7 P21/c 293 MoKa tube R R-AXIS RAPID 12157 25.1 0.023 2873 236 CrystalStruct 0.055 0.115 0.990
o1726-o172Sonar C16H15NOS 269.4 P1 90 MoKa tube N KappaCCD 7534 27.5 0.029 2858 172 DENZO-SMN 0.026 0.070 0.997
o1729-o173Wardell C16H12N2O3 280.3 P21/n 120 MoKa RA N KappaCCD 8160 25.5 0.115 2875 192 DENZO-SMN 0.122 0.126 0.957
o1731-o173Vyas C21H20F3N3 483.5 P-1 298 CuKa R AFC-7S 4902 68.0 0.051 3854 325 CRYSTALS 0.088 1.000
o1733-o173Shi C22H17Cl2N 414.3 P21/n 292 MoKa tube S P4 4195 25.0 0.013 3379 263 SHELXTL 0.070 0.127 1.000
o1735-o173Kraus C8H9BrN2O3 261.1 P21/c 173 MoKa tube B SMART1000 CCD 3396 25.0 0.039 1958 127 SAINT 0.047 0.107 0.841
o1738-o173Li C19H24O4S2 380.5 C2/c 293 MoKa tube B SMART CCD 5007 26.4 0.032 1889 114 SAINT 0.070 0.115 0.997
o1740-o174Yin C19H24N4O 324.4 P21/c 183 MoKa tube B SMART CCD 7045 25.0 0.066 3053 217 SAINT and SHE 0.150 0.142 0.998
o1742-o174Li C16H12O2 236.3 P21 293 MoKa tube S SMART CCD 7540 28.3 0.015 3147 324 SAINT 0.042 0.100 0.993
o1745-o174Choudhary C22H28O2 324.4 C2 293 MoKa tube S SMART CCD 6003 27.6 0.018 2221 216 SAINT 0.059 0.151 0.984
o1748-o175Karakurt C28H16N2O2 412.4 P-1 293 MoKa tube Stoe IPDS 2 13294 25.0 0.090 3606 354 X-RED 0.100 0.069 1.000
o1751-o175Choudhary C26H46N2O 402.7 P21 293 MoKa tube S SMART CCD 6796 25.0 0.026 2333 263 SAINT 0.080 0.192 0.999
o1754-o175Jian C12H20N4OS 300.4 P21/c 293 MoKa tube Oxford Instrument 5132 27.5 0.025 3130 173 R-AXIS Softwa 0.091 0.114 0.995
o1757-o175Khan C18H30N6 330.5 P-1 133 MoKa tube B SMART 1000 CCD 12279 28.0 0.031 4407 217 SAINT 0.054 0.117 0.994
o1759-o176Pringle C11H20N2O3 260.4 Pbca 123 MoKa tube N KappaCCD 29344 27.5 0.063 3219 155 X-Seed 0.083 0.145 0.996
o1762-o176Thamotharan C17H12N2O3 292.3 P21/c 293 MoKa tube Stoe IPDS 13010 29.5 0.026 3882 199 IPDS 0.080 0.207 0.990
o1764-o176Sarkar C28H16Br2 512.2 C2/c 298 MoKa tube EN MACH3 4C 5669 25.0 0.034 5380 406 WinGX 0.126 0.175 0.485
o1766-o176Smith C9H7NO2 161.2 P21/n 295 MoKa Rigaku RA R AFC-7R 2023 27.5 0.054 1723 118 TEXSAN for Wi 0.080 0.152 0.999
o1768-o176Rajnikant C11H11NO 173.2 P21/c 293 MoKa EN CAD-4 1737 25.0 0.009 1629 121 CAD-4 Softwar 0.055 0.135 0.997
o1770-o177Kania-Korwe C6H2Cl3I 307.3 P21/c 90 MoKa tube N KappaCCD 3722 27.5 0.019 1891 91 DENZO-SMN 0.026 0.052 0.999
o1772-o177Song C8H14N2O2 170.2 P21 293 MoKa tube B SMART CCD 2515 25.0 0.048 960 110 SAINT 0.070 0.144 0.990
o1774-o177Nabih C26H22Cl2N 493.4 P21/c 293 MoKa tube N KappaCCD 13006 26.4 0.035 4710 310 DENZO and SCA 0.079 0.172 0.971
o1777-o177Butcher C6H5N3O2 151.1 P212121 296 CuKa tube CCD 2994 66.9 0.036 686 101 SAINT 0.036 0.093 0.953
o1780-o178Butcher C6H3N5O6 241.1 Pc21b 93 MoKa tube B SMART CCD 4530 25.4 0.102 851 155 SAINT 0.051 0.110 0.999
o1783-o178Seshadri C30H24N2O5 492.5 P21/c 293 MoKa tube CCD 14548 28.0 0.027 5528 334 SAINT 0.079 0.139 0.949
o1786-o178Fresu C18H30O4 310.4 P-1 291 MoKa tube N KappaCCD 13476 27.5 0.023 4008 202 DENZO and SCA 0.057 0.131 0.995
o1788-o178Kolev C17H20ClNO 305.8 P21/n 291 MoKa tube N KappaCCD 11432 27.5 0.080 3684 193 DENZO and SCA 0.138 0.062 0.997
o1790-o179Cherouana C7H9N1O6S1 235.2 P21/c 293 MoKa tube N KappaCCD 12041 30.0 0.034 2654 137 DENZO and SCA 0.043 0.115 0.990
o1793-o179Fukunaga C11H13Cl2N 294.1 C2/c 299 MoKa Rigaku RA R AFC-5R 3924 27.5 0.028 2866 216 TEXSAN for Wi 0.074 0.093 0.998
o1796-o179Li C22H19N5O2 417.5 P21/c 293 MoKa tube B SMART CCD 9314 25.0 0.064 3582 273 SAINT 0.156 0.999
o1798-o180Rahman C22H23NO5S 413.5 P-1 293 MoKa tube S SMART CCD 10593 25.0 0.023 3518 269 SAINT 0.069 0.155 0.997
o1801-o180Low C20H14FN3 315.3 R-3 120 MoKa tube N KappaCCD 28120 27.5 0.105 3780 218 DENZO-SMN 0.091 0.162 0.998
o1804-o180Low C19H19N3O 305.4 P-1 120 MoKa tube N KappaCCD 32382 25.0 0.080 7071 421 DENZO-SMN 0.096 0.138 0.986
o1807-o180Loughlin C10H14N2O3 210.2 P-1 295 MoKa Rigaku RA R AFC-7R 4100 25.0 0.019 3872 272 TEXSAN for Wi 0.080 0.188 0.999
o1810-o181Li C21H15Cl2N 472.3 P21/c 293 MoKa tube B SMART CCD 11420 26.4 0.035 4299 330 SAINT 0.078 0.119 0.998
o1812-o181Stacy C5H3BrOS 191.0 P21/c 100 MoKa tube B SMART CCD 5955 28.3 0.034 1499 73 SAINT 0.021 0.047 0.999
o1814-o181Li C41H28Cl9N 929.7 P-1 293 MoKa tube B SMART CCD 12075 25.0 0.022 8424 594 SAINT 0.085 0.132 0.985
o1817-o181Sandoval-Ra C33H50O6 542.7 P21 300 MoKa B P4 7849 28.0 0.028 4144 363 XSCANS 0.054 0.133 1.000
o1820-o182Muller C20H24N2 292.4 P21/c 173 MoKa tube S CCD three-circl 11184 25.4 0.044 1597 104 SAINT 0.071 0.125 1.000
o1822-o182Zhang C14H11Cl2N 296.1 C2/c 293 MoKa tube S SMART CCD 8171 28.3 0.028 3302 205 SAINT 0.081 0.138 0.993
o1824-o182Shi C18H10Cl2O 329.2 P-1 293 MoKa tube S SMART CCD 3542 25.0 0.017 2482 239 SAINT 0.061 0.128 0.973
o1827-o182Fun C16H16N2O5 316.3 P-1 293 MoKa tube S SMART CCD 3825 25.0 0.020 2665 231 SAINT 0.043 0.103 0.981
o1830-o183Yang C14H24Cl2N 447.3 P21/c 293 MoKa tube B SMART CCD 4254 26.0 0.015 1915 128 SHELXTL 0.055 0.138 0.924
o1832-o183Gadepalli C22H30N2O 338.5 P212121 100 MoKa tube N KappaCCD 22786 33.7 0.017 4004 227 HKL DENZO and 0.037 0.089 0.986
o1835-o183Etti C13H12N4O6 320.3 P-1 293 MoKa tube B SMART APEX CCD 4623 25.0 0.013 3210 256 SAINT 0.053 0.128 0.918
o1838-o183Muller C64H60OSi2 901.3 P21/c 173 MoKa tube S CCD three-circl 77354 30.7 0.126 14554 558 SAINT 0.349 0.363 0.922
o1840-o184Crane C13H18Cl2N 337.3 P-1 150 MoKa tube Stoe IPDS-II 12767 29.8 0.072 4668 196 X-RED 0.090 0.109 0.982
o1843-o184Shi C25H21N3O2 395.5 P21/c 296 MoKa tube S P4 4424 25.5 0.024 3873 278 SHELXTL 0.107 0.127 1.000
o1846-o184Shi C22H15N3 321.4 P21/c 291 MoKa tube S P4 6709 25.0 0.015 5856 452 SHELXTL 0.102 0.094 1.000
o1849-o185Britton C14H8N2 204.2 P21 173 MoKa tube B SMART 5937 27.5 0.068 1249 146 SAINT 0.062 0.116 0.996
o1852-o185Li C35H26Cl4N 664.4 P-1 293 MoKa tube B SMART CCD 9083 26.4 0.021 6351 397 SAINT 0.097 0.135 0.986
o1854-o185Crane C15H23N3O2 277.4 P21/c 150 MoKa tube Stoe IPDS-II 22744 27.5 0.060 3601 190 X-RED 0.069 0.072 0.999
o1856-o185Thamotharan C17H19NO 253.3 P212121 160 MoKa N FR591 t N KappaCCD 18762 27.5 0.058 1917 177 DENZO-SMN and 0.065 0.112 0.996
o1858-o185Ye C32H50O5 514.7 P212121 296 MoKa tube S P4 4120 27.5 0.010 3990 346 XSCANS 0.087 0.086 1.000
o1860-o186Rademeyer C7H10N2O3 170.2 Pbca 120 MoKa tube Oxford Excalibur2 13426 25.0 0.037 2060 121 CrysAlis RED 0.088 0.172 0.995
E59 Part 12
i156-i157 Becker C4H8CoN6O4 391.3 P-421c 100 MoKa tube Stoe IPDS II 2C 5438 27.2 0.043 882 44 X-AREA 0.062 0.177 0.991
i158-i160 Beck As4F24O4S2 1649.4 P-1 125 MoKa N KappaCCD 12374 27.5 0.070 6331 361 COLLECT 0.072 0.077 0.995
i161-i163 Sugahara LiMnO4V 176.8 Cmcm 297 MoKa tube R AFC-5S 1759 50.0 0.014 1663 26 MSC Software 0.022 0.033 1.000
i164-i166 Kolitsch Cr3Cs2O10 581.8 Pbca 293 MoKa tube N KappaCCD 7678 32.6 0.011 4071 137 HKL DENZO and 0.024 0.053 1.000
m1086-m108Lu C12H24CuN1 404.0 P21/c 293 MoKa tube B SMART 1K CCD 3429 25.0 0.020 1501 131 SAINT 0.033 0.080 0.997
m1089-m109Zhu C18H32Cl2C 610.4 P-1 298 MoKa tube B SMART CCD 3747 25.0 0.021 2494 169 SAINT 0.050 0.131 0.980
m1091-m109Jones C16H28F3N2 488.4 C2221 180 MoKa tube N KappaCCD 6274 22.0 0.048 2212 239 HKL DENZO and 0.048 0.101 0.983
m1094-m109Li C8H14N4NiO 288.9 Ibam 295 MoKa tube R R-AXIS RAPID 4806 27.5 0.028 705 53 CrystalStruct 0.038 0.103 1.000
m1096-m109Liu C20H23N8Ni 682.4 P21/c 295 MoKa tube R R-AXIS RAPID 25568 27.4 0.035 6343 379 CrystalStruct 0.065 0.112 1.000
m1099-m110Zhang C15H35Cl2C 543.3 P21/n 293 MoKa tube R AFC-7R 4450 0.031 2297 280 TEXSAN ? 0.061
m1102-m110Rabe C36H41OTm 658.6 Pbca 218 MoKa tube B SMART 4K CCD 33690 25.0 0.059 5203 359 SAINT 0.047 0.072 0.999
m1104-m110Butcher C14H12CuN2 319.8 P21/c 293 MoKa tube B P4 2698 27.5 0.000 2698 181 XSCANS 0.042 0.086 0.998
m1107-m110Butcher C15H11Cl3I 454.4 P21/n 103 MoKa tube B SMART CCD 12733 28.3 0.040 3965 200 SAINT 0.026 0.058 0.983
m1110-m111Alcock C6H8AgI2N 455.8 Cmca 180 MoKa tube S SMART 12054 26.0 0.039 2564 108 SAINT 0.038 0.070 0.937
m1112-m111Healy C25H22Au2C 849.2 P-1 295 MoKa Rigaku RA R AFC-7R 5139 25.0 0.017 4519 281 TEXSAN for Wi 0.049 0.096 0.998
m1115-m111Ren C20H11BrN5 588.2 P21/c 293 MoKa tube B SMART CCD 33754 25.0 0.036 12054 838 SMART 0.096 0.120 0.995
m1118-m112Ali C24H24N4O5 610.0 P-1 293 MoKa tube B SMART APEX CCD 10224 26.0 0.026 5322 344 SAINT 0.065 0.149 0.980
m1121-m112Baggio C48H50Dy2N 1231.9 P-1 297 MoKa tube B SMART APEX CCD 9966 25.0 0.025 5166 350 SAINT-NT 0.042 0.092 0.891
m1124-m112Liao C4H20Cl3N8 541.6 Fdd2 293 MoKa tube B AXS APEX CCD 6486 28.3 0.027 2185 142 SAINT-Plus 0.024 0.055 1.000
m1127-m112Borkowski C16H20CuN2 399.9 P21/n 293 MoKa tube R R-AXIS RAPID 13951 28.3 0.048 2020 155 HKL 0.046 0.072 0.998
m1129-m113Dagur C12H38Cr2N 681.2 P21/c 293 MoKa tube B SMART CCD 37222 25.0 0.036 9189 779 SAINT 0.062 0.130 1.000
m1131-m113Keene C16H18CuN4 457.9 P21/c 120 MoKa N KappaCCD 8409 27.5 0.086 2023 142 DENZO and COLLECT 0.091 0.994
m1134-m113Sadr C16H40Cl2C 682.7 P21/n 150 MoKa tube B SMART 1K CCD 15663 25.0 0.048 4845 252 SAINT 0.058 0.071 0.994
m1137-m113Zeng C10H13CuNO 354.8 P21/c 291 MoKa tube S P4 2761 25.5 0.014 2409 202 SHELXTL 0.040 0.073 1.000
m1140-m114Villanueva C60H20F30P 1713.7 C2/c 296 MoKa B P4 6476 25.0 0.037 5561 442 XSCANS 0.092 0.111 1.000
m1143-m114Zhang C7H9CoNO7 278.1 Pca21 298 MoKa tube S R3m 4C 3513 25.0 0.036 1480 163 R3m Software 0.035 0.068 1.000
m1146-m114Akkurt C44H48Ge2O 902.3 P-1 294 MoKa tube N KappaCCD 49113 29.0 0.076 11629 496 EVALCCD 0.126 0.109 0.991
m1149-m115Zhang C30H30Cu2N 827.6 P-1 298 MoKa tube B APEX 4524 27.0 0.027 3338 235 SAINT 0.060 0.133 0.950
m1151-m115Lee C14H23AsN2 374.3 P-1 120 MoKa tube EN KappaCCD 18359 27.5 0.122 3846 158 COLLECT 0.049 0.112 0.992
m1154-m115Francis C9H8KNO5S 281.3 P21/c 293 MoKa tube Philips PW 1100 3023 30.0 0.024 2802 154 MolEN 0.067 0.157 0.873
m1157-m115Francis C9H16CuINO 520.8 P21/c 293 MoKa tube B SMART with CCD 14839 28.2 0.143 3625 208 SAINT 0.059 0.090 0.917
m1160-m116Francis C18H16CaI2 794.4 P21/c 293 MoKa tube Kuma KM-4 CCD \k- 26674 26.1 0.053 4771 325 KM-4 CCD Soft 0.072 0.103 0.995
m1164-m116Muthiah C9H12BaINO 558.4 P-1 293 MoKa tube B SMART CCD 8112 28.3 0.043 3329 190 SAINT 0.082 0.236 0.870
m1168-m117Zeng C21H21Cl3C 606.9 C2/c 150 MoKa tube N KappaCCD 9609 27.5 0.066 2633 152 DENZO-SMN 0.068 0.096 1.000
m1171-m117Garcia C18H14CuO8 421.8 P21/c 296 MoKa B P4 5583 25.0 0.024 3135 244 XSCANS 2.21 0.043 0.076 1.000
m1174-m117Kraatz C20H25FeNO 415.3 P31 193 MoKa B PLATFORM/SMART 16410 26.4 0.025 8093 487 SAINT 0.043 0.095 0.998
m1176-m117Zhang C22H18CuN2 421.9 P21/n 298 MoKa tube B APEX 10709 27.5 0.035 4087 273 SAINT 0.067 0.117 0.980
m1178-m118Sakai C15H40Cl2N 961.6 C2/m 296 MoKa tube B SMART APEX CCD 11137 27.6 0.064 3676 183 SAINT 0.082 0.079 0.998
m1181-m118Langer C16H17CuN3 394.9 P21/n 183 MoKa tube B CCD 28068 32.0 0.041 5922 243 SAINT & SADAB 0.061 0.144 0.959
m1184-m118Liddle C20H40IKO8 574.5 P41212 160 MoKa tube B SMART 1K CCD 26143 25.0 0.050 4570 273 SAINT 0.044 0.081 0.999
m1187-m118Shiu C52H40O4P2 1057.0 Pnma 294 MoKa tube S SMART CCD 29562 0.106 5947 295 SAINT 0.134 0.069
m1189-m119Shiu C12H20Cl2N 438.0 C2/c 295 MoKa tube B SMART CCD 5720 25.0 0.026 2231 115 SAINT 0.036 0.063 0.974
m1192-m119He C26H28CoN6 611.5 P-1 293 MoKa tube CCD 3999 26.8 0.036 2824 243 SHELXTL 0.050 0.078 0.976
m1194-m119Zhang C14H12N2O4 401.8 C2/c 298 MoKa tube B SMART CCD 4426 27.0 0.069 1726 105 SAINT 0.059 0.109 0.990
m1196-m119He C28H50N2Ni 660.1 P-1 298 MoKa tube B Model 5189 27.2 0.019 3608 185 SAINT 0.078 0.193 0.950
m1198-m120Peters C19H10F3Mo 502.2 Pbca 293 MoKa tube S B P4 4476 25.0 0.030 3547 299 XSCANS 0.054 0.077 0.990
m1201-m120Maris C8H16Cl3Mn 319.5 Pbca 110 MoKa Tube DIP2000 12699 25.8 0.040 2356 149 DENZO and SCA 0.071 0.127 0.997
o1862-o186Wang C30H33Br3O 729.3 P21/n 293 MoKa tube B SMART CCD 18616 25.0 0.062 6129 383 SAINT 0.121 0.164 0.994
o1864-o186Chantraprom C41H60Cl2O 687.8 P21 293 MoKa tube S SMART CCD 10423 26.0 0.020 7198 445 SAINT 0.078 0.152 0.995
o1867-o186Sampson C20H30O4 334.5 P212121 123 MoKa tube B P4 CCD 12757 26.0 0.070 2177 217 SAINT and Xtal3.7 AD 0.079 0.934
o1869-o187Fukunaga C6H8N2O5 188.1 P21/a 298 MoKa Rigaku RA R AFC-5R 6785 31.0 0.021 2617 151 TEXSAN for Wi 0.066 0.120 1.000
o1872-o187Sousa C18H34N2O2 310.5 C2/c 123 MoKa tube B SMART 1K CCD 5446 26.5 0.024 1852 108 SAINT-Plus 0.054 0.131 0.995
o1875-o187Govind C29H23NO3 433.5 P21/c 293 MoKa tube CCD 14010 25.0 0.022 5225 298 SAINT 0.081 0.187 0.906
o1878-o188Govind C30H29N3O2 463.6 P21/n 293 MoKa tube CCD 15727 25.0 0.031 5738 316 SAINT 0.086 0.148 0.915
o1881-o188Zhang C8H8N2O2 164.2 Pnma 293 MoKa tube B SMART CCD 2209 25.0 0.022 921 74 SAINT 0.074 0.159 0.988
o1883-o188Li C25H18N2O4 410.4 P21/c 293 MoKa tube S SMART CCD 9901 25.0 0.027 3567 337 SAINT 0.079 0.136 0.996
o1886-o188Shan C20H15N3O3 345.4 C2/c 295 MoKa tube R R-AXIS RAPID 15870 27.5 0.024 3909 235 CrystalStruct 0.067 0.127 1.000
o1888-o189Kuehl C32H49ClO9 613.2 P3121 170 MoKa tube B SMART CCD 52513 25.6 0.133 6110 325 SAINT 0.096 0.118 0.999
o1891-o189Lu C22H14N4O4 398.4 Pca21 298 MoKa tube B SMART 8901 27.0 0.021 2062 271 SAINT 0.050 0.091 0.990
o1894-o189Hartung C22H24ClN3 510.1 P212121 299 MoKa tube Oxford Xcalibur C 17136 26.4 0.055 5188 289 CrysAlis RED 0.111 0.135 0.986
o1896-o189Aberdeen C20H12F12N 508.3 P-1 150 MoKa tube Stoe IPDS-II 10945 32.3 0.036 3638 166 X-RED 0.079 0.192 0.993
o1898-o190Du C10H9N5O8 327.2 P21 293 MoKa B SMART 1000 2660 25.0 0.022 1187 209 SAINT 0.044 0.111 0.997
o1901-o190Fun C30H25NO4 463.5 Pbca 293 MoKa tube S SMART CCD 28443 28.3 0.017 5925 382 SAINT 0.053 0.143 0.994
o1903-o190Ravishankar C19H15BrN2 447.3 P21/c 293 MoKa tube S SMART CCD 11117 25.0 0.016 4435 245 SAINT 0.032 0.071 0.985
o1907-o190Li C20H19NO5 353.4 P-1 293 MoKa tube S SMART CCD 4335 25.0 0.011 2990 248 SAINT 0.050 0.117 0.982
o1909-o191Jin C7H11.50N4 211.8 I41/a 293 MoKa tube S P4 2473 26.5 0.020 2158 144 XSCANS 0.066 0.095 1.000
o1912-o191Silva C10H16F6N4 402.3 P21 293 MoKa tube EN CAD-4 2752 30.1 0.024 2610 267 HELENA 0.077 0.134 0.998
o1915-o191Robinson C20H16O1 272.3 P21/n 296 MoKa tube R AFC-5S 5546 25.1 0.024 5289 384 PROCESS in TE 0.105 0.128 0.999
o1918-o191Gathergood C28H25N1O4 439.5 P21 123 MoKa tube N KappaCCD 14873 27.5 0.044 2909 300 HKL DENZO and 0.052 0.082 0.985
o1920-o192You C20H20N4O7 428.4 P21/c 298 MoKa tube B SMART CCD 9917 25.0 0.050 3390 360 SAINT 0.119 0.198 0.973
o1923-o192Cao C32H27N 425.6 Cc 293 MoKa tube B SMART CCD 5052 25.0 0.028 2130 300 SAINT 0.090 0.154 0.999
o1925-o192Clegg C22H24INO4 493.3 P212121 160 MoKa tube B SMART 1K CCD 13825 26.0 0.029 5121 256 SAINT 0.034 0.051 0.939
o1927-o192Fettinger C14H24N6O1 436.4 C2/c 203 MoKa tube B SMART CCD 36186 30.0 0.018 5486 380 SAINT 0.038 0.099 0.998
o1930-o193Zhang C18H8Cl4O2 398.0 C2/c 293 MoKa tube S SMART CCD 4882 25.0 0.016 1972 126 SAINT 0.033 0.085 0.983
o1932-o193Kocaokutgen C17H20N2O 268.4 P212121 208 MoKa tube B AXS SMART CCD 8784 25.0 0.042 1543 181 SAINT 0.045 0.089 0.999
o1935-o193Guilardi C20H29FO3 336.4 P212121 293 MoKa EN CAD-4 2095 26.3 0.046 2093 220 XCAD4 0.107 0.998
o1938-o194Coruh C16H22N4S2 334.5 Pbca 293 MoKa tube Stoe IPDS2 26348 27.8 0.092 4367 199 X-RED 0.150 0.096 0.995
o1941-o194Tomura C6H2N2S2 166.2 P-1 296 MoKa RA R AFC-7R 1678 27.5 0.054 1571 99 TEXSAN 0.176 0.139 1.000
o1944-o194Song C14H10BrN 272.1 Fdd2 293 MoKa tube B SMART CCD 6379 26.0 0.075 2284 145 SAINT 0.064 0.088 0.998
o1946-o194Clegg C31.50H34. 682.6 P21 160 CuKa Bede Micr Stoe-S 4C 8184 67.2 0.037 5020 341 local program 0.060 0.153 0.927
o1949-o195Turktekin C21H20N2O2 332.4 P21/c 293 MoKa EN CAD-4 3491 26.3 0.000 3491 226 XCAD4 0.145 0.197 0.967
o1951-o195Jones C4H5NO3 115.1 P212121 133 MoKa tube B SMART 1000 CCD 5566 30.0 0.071 860 77 SAINT 0.044 0.109 0.999
o1953-o195Takahashi C16H21NO3 275.3 P21 173 MoKa tube R R-AXIS RAPID IP 6718 27.5 0.026 3662 363 TEXSAN 0.048 0.103 1.000
o1956-o195Yang C12H13N5O6 323.3 P21/c 293 MoKa tube B P4 2748 25.5 0.011 2748 239 SHELXTL 0.064 0.130 1.000
o1958-o195Baell C17H14N2O6 342.3 P21/c 123 MoKa tube N KappaCCD 18179 27.5 0.078 3764 228 HKL DENZO and 0.126 0.109 0.979
o1960-o196Lu C21H28N4 336.5 P21/c 298 MoKa tube S SMART CCD 31805 25.1 0.059 13700 902 SAINT 0.152 0.181 0.999
o1962-o196Dupont C17H17ClN4 328.8 P21/n 293 MoKa tube Stoe-S AED 4C 4860 30.0 0.024 4581 210 REDU4 0.079 0.114 0.999
o1964-o196Vrabel C22H28N2O6 480.6 P21 293 MoKa tube Oxford Xcalibur C 7507 30.3 0.022 5925 330 CrysAlis RED 0.106 0.096 0.989
o1967-o196Sundar C17H11NO2S 325.4 P21/c 293 CuKa tube N KappaCCD 4416 69.2 0.026 2338 200 DENZO and SCA 0.094 0.151 0.860
o1970-o197Martin C23H25NOS 363.5 P212121 298 CuKa tube EN CAD-4 2178 69.8 0.000 2178 243 XCAD4 0.121 1.000
o1972-o197Stomberg C24H30O8 446.5 P21 153 MoKa RA R AFC6 3660 30.0 0.013 3479 311 TEXSAN-TEXRAY 0.060 0.121 0.999
o1975-o197Koysal C19H20ClN3 357.8 P-1 293 MoKa tube Stoe IPDS-2 6303 26.0 0.041 3201 227 X-RED 0.046 0.128 0.939
o1977-o197Smith C15H15N3O7 349.3 P1 293 MoKa tube B SMART CCD 5055 27.5 0.041 3494 485 SAINT 0.063 0.107 0.990
o1980-o198Raj C48H48N8O1 1009.1 P-1 293 MoKa tube B AXS SMART CCD 29740 30.5 0.055 12128 688 SMART 0.099 0.174 0.850
o1984-o198Ishida C7H4ClNO4 201.6 P21/c 297 MoKa Rigaku RA R AFC-5R 2234 27.5 0.011 1815 135 teXsan for Wi 0.049 0.087 0.999
o1987-o198Clegg C11H19NO5 245.3 P212121 160 MoKa tube B SMART 1K CCD 7889 26.0 0.028 1786 160 SAINT 0.038 0.075 0.939
o1990-o199Spirlet C18H21N5 307.4 Pbca 293 MoKa tube B P4 6621 25.0 0.031 2952 214 SHELXTL 0.137 0.106 1.000
o1992-o199Bond C68H8S2 888.9 P21/c 120 MoKa tube N KappaCCD 12159 23.0 0.118 2372 322 HKL DENZO and 0.121 0.227 0.989
o1994-o199Yin C7H10N2O5 202.2 C2/c 183 MoKa tube CCD 3564 25.0 0.023 1590 127 SAINT and SHE 0.061 0.142 0.996
o1997-o199Karakurt C21H28N4O2 400.5 P212121 293 MoKa tube Stoe IPDS 2 9857 25.0 0.044 3703 254 X-RED 0.075 0.110 1.000
o2000-o200Palusiak C17H18O4 286.3 P21 293 CuKa R AFC-5S 4913 67.5 0.061 1388 193 TEXSAN 0.185 0.970
o2003-o200Crane C34H31NO3 501.6 P-1 150 MoKa tube Stoe IPDS-II 27584 32.3 0.086 8874 347 X-RED 0.109 0.144 0.993
o2005-o200Clark C15H25NO2S 283.4 P21/c 100 MoKa tube KappaCCD 26071 27.5 0.035 3590 185 Denzo and Sca 0.073 0.136 0.999
o2007-o200Wolska C22H18N2O4 374.4 P21/n 293 CuKa tube KM-4 4C 9752 67.5 0.043 3689 308 KM-4 Software 0.086 0.138 0.982
o2010-o201Sonar C16H21NO3 275.3 P21/c 90 MoKa tube N KappaCCD 5998 27.4 0.030 3074 184 DENZO-SMN 0.072 0.130 0.999
o2013-o210Huo C7H9BrN2O2 233.1 P-1 183 MoKa tube B SMART 1K CCD 5487 25.0 0.018 4564 325 SHELXTL 0.048 0.079 0.979
o2015-o201Muthiah C24H24N2O1 628.6 P21/c 293 CuKa tube EN CAD-4 2541 69.9 0.043 2418 200 CAD-4 Softwar 0.052 0.131 1.000
o2018-o201Cao C30H23N 397.5 P-1 293 MoKa tube B SMART CCD 5593 25.0 0.018 3781 280 SAINT 0.085 0.121 0.992
o2020-o202Yu C15H12Cl2O 295.2 P21/c 293 MoKa tube B SMART CCD 7777 26.4 0.030 2815 173 SAINT 0.072 0.111 0.999
o2022-o202Baranowska C20H49N2O4 441.8 P-1 200 MoKa tube Kuma KM-4 4475 25.0 0.020 4254 310 DATAPROC 0.079 0.131 0.877
o2025-o202Seshadri C26H19N3O5 453.4 P-1 293 MoKa tube CCD 6822 28.0 0.014 4747 307 SAINT 0.071 0.163 0.909
o2028-o202Neels C36H22N8 566.6 P21/n 223 MoKa tube STOE IPDS 10763 25.9 0.133 2771 199 INTEGRATE 0.142 0.096 0.994
o2030-o203Neels C36H22N8 566.6 Fdd2 223 MoKa tube STOE IPDS 10285 25.9 0.107 1396 199 INTEGRATE 0.086 0.087 0.998
o2032-o203Gilardi C5H8F4N2O 188.1 C2/c 93 MoKa tube B CCD 2995 28.3 0.060 877 72 SAINT 0.038 0.102 0.981
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Page Auth Formula Mr SPG Temp Source Device Obs.REF Qmax Rint NREF Npar Data reduction Rall wRall Fraction
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