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multiple.cif
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multiple.cif
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# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 5.90630 24.95840 25.98080
C C2 4.70410 24.15610 26.76250
C C3 4.31370 24.97230 28.03480
C C4 5.68430 25.18440 28.77460
C C5 6.73560 26.01490 27.88890
O O6 7.12580 25.08060 26.80680
N N7 3.51130 23.99050 25.92540
C C8 3.11080 22.80710 25.39670
O O9 3.73840 21.84960 25.50730
C C10 1.80370 22.85880 24.67670
O O11 3.36930 24.20520 28.80110
C C12 7.95040 26.34910 28.70970
O O13 8.24970 25.13280 29.55590
O O14 5.57380 25.91090 30.03470
C C15 4.57650 26.69580 30.74440
C C16 3.83700 27.76770 29.94910
C C17 3.01390 28.60640 30.87440
C C18 2.22280 27.73370 31.89440
C C19 3.03050 26.57890 32.52230
O O20 3.69850 25.83680 31.49890
N N21 4.95240 28.59190 29.29130
C C22 4.77640 29.28760 28.15190
O O23 3.89230 29.07780 27.44420
C C24 5.79950 30.34290 27.90910
O O25 1.77680 28.58160 33.00560
O O26 2.05760 29.34230 30.08650
C C27 2.11950 25.58250 33.22690
O O28 0.75130 25.62430 32.71980
O O29 6.26410 24.20630 24.76180
C C30 8.62730 24.36040 21.36710
C C31 8.90080 25.53990 22.33430
C C32 8.24170 25.26520 23.67000
C C33 6.74940 24.85420 23.41500
C C34 6.47970 23.88580 22.25440
O O35 7.17830 24.40970 21.06500
N N36 10.35850 25.72460 22.47450
C C37 10.94780 26.92620 22.69210
O O38 10.32850 27.88810 22.74050
C C39 12.42310 26.84770 22.85710
O O40 8.21630 26.41910 24.52320
O O41 9.26270 24.72790 20.14760
C C42 5.01850 23.78070 21.89170
O O43 4.12650 24.60340 22.78000
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 3.37000 27.16320 29.03670
C C2 4.95960 27.25580 29.44280
C C3 5.80250 26.66150 28.27070
C C4 5.16490 25.24390 28.03670
C C5 3.61810 25.33090 27.61340
O O6 2.92210 25.76760 28.84670
N N7 5.39240 28.63670 29.68050
C C8 5.81420 29.10600 30.88150
O O9 5.78370 28.45770 31.83110
C C10 6.31670 30.51180 30.85760
O O11 7.18000 26.60260 28.67890
C C12 3.11360 23.96960 27.22170
O O13 3.10390 23.92920 25.71070
O O14 5.81470 24.46530 26.98810
C C15 6.51500 24.71110 25.73770
C C16 7.95390 24.21390 25.63460
C C17 8.57920 24.73190 24.37850
C C18 7.62950 24.57380 23.15350
C C19 6.15980 24.96050 23.41910
O O20 5.69640 24.32810 24.61460
N N21 8.64520 24.78620 26.87990
C C22 9.89500 24.44540 27.24740
O O23 10.40990 23.49940 26.83940
C C24 10.54030 25.39650 28.19520
O O25 8.09870 25.44280 22.06840
O O26 9.77030 23.96380 24.11710
C C27 5.24490 24.46340 22.30780
O O28 5.95080 23.63590 21.33410
O O29 2.56670 27.74700 30.12920
C C30 0.32770 27.35920 33.58890
C C31 1.72100 26.69100 33.70600
C C32 2.59180 27.12440 32.54500
C C33 1.78740 26.91920 31.21410
C C34 0.31110 27.34130 31.21730
O O35 -0.32100 26.74290 32.40880
N N36 2.32480 27.05200 35.00370
C C37 2.35690 26.22260 36.07590
O O38 1.86930 25.18740 36.03720
C C39 3.07130 26.79000 37.24960
O O40 3.79180 26.34540 32.43120
O O41 -0.41110 26.87030 34.70300
C C42 -0.45590 26.84040 30.01800
O O43 0.14110 25.60270 29.40720
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 3.56970 27.33800 28.52430
C C2 3.21570 25.75020 28.29180
C C3 4.52730 25.00810 27.88390
C C4 5.06570 25.84700 26.66840
C C5 5.39540 27.36620 27.07150
O O6 4.06750 27.98580 27.29270
N N7 2.67440 25.11930 29.49990
C C8 3.32290 25.07400 30.69070
O O9 4.39720 25.46640 30.81190
C C10 2.52820 24.48450 31.80890
O O11 4.19880 23.65230 27.53510
C C12 6.07870 28.06580 25.92930
O O13 5.23980 27.80720 24.69860
O O14 6.29350 25.32230 26.08100
C C15 6.75820 24.86190 24.78240
C C16 5.69730 24.42270 23.77740
C C17 6.35450 23.78990 22.59220
C C18 7.57460 24.62230 22.09620
C C19 8.49750 25.14860 23.21500
O O20 7.71930 25.78450 24.23180
N N21 4.83900 23.40940 24.54740
C C22 3.58990 23.07220 24.17430
O O23 2.97750 23.72380 23.44850
C C24 3.09420 21.79580 24.76130
O O25 8.40850 23.78080 21.23060
O O26 5.39310 23.73210 21.52010
C C27 9.44860 26.21770 22.69380
O O28 10.63740 25.64750 22.06710
O O29 2.33940 28.04280 28.93560
C C30 3.86500 30.16240 32.14700
C C31 2.63590 29.30160 32.53450
C C32 2.31980 28.33340 31.41350
C C33 2.26210 29.13280 30.06500
C C34 3.35100 30.18980 29.83190
O O35 3.41630 31.03630 31.03870
N N36 2.91710 28.59590 33.80000
C C37 1.96430 28.26910 34.70770
O O38 0.87020 28.56740 34.54950
C C39 2.48530 27.50940 35.87440
O O40 1.04420 27.69580 31.57510
O O41 4.05880 31.04520 33.24660
C C42 3.05420 31.10700 28.67070
O O43 2.22610 30.45570 27.59750
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 6.91090 25.04630 26.50010
C C2 5.39310 24.41840 26.55050
C C3 4.43580 25.49280 27.15590
C C4 5.13260 25.89150 28.50730
C C5 6.59280 26.52050 28.28060
O O6 7.42510 25.37390 27.84650
N N7 4.90170 24.04650 25.21980
C C8 4.08040 22.99400 24.97840
O O9 3.77320 22.26090 25.80980
C C10 3.61650 22.87940 23.56390
O O11 3.13850 24.90060 27.34070
C C12 7.13170 27.05350 29.57930
O O13 6.64250 26.12330 30.66580
O O14 4.39660 26.88090 29.28660
C C15 3.28000 26.90870 30.21760
C C16 3.21540 28.07880 31.19480
C C17 2.13670 27.83750 32.20230
C C18 0.82400 27.33200 31.53230
C C19 1.02460 26.25610 30.44480
O O20 2.03740 26.67300 29.52590
N N21 4.60120 28.10140 31.85470
C C22 5.34410 29.21910 31.96370
O O23 5.13520 30.15080 31.31970
C C24 6.42480 29.14430 32.98640
O O25 -0.03670 26.73150 32.55770
O O26 1.84530 29.08640 32.85980
C C27 -0.23600 26.06650 29.61160
O O28 -1.19330 27.15320 29.79550
O O29 7.81860 24.04570 25.90480
C C30 10.90080 26.58940 24.82670
C C31 10.26050 25.88240 23.60530
C C32 8.96610 25.21680 24.02430
C C33 9.23870 24.36050 25.31010
C C34 10.12020 24.99250 26.39690
O O35 11.33680 25.50820 25.74000
N N36 10.04120 26.87160 22.53190
C C37 10.85110 27.00340 21.45250
O O38 11.79230 26.36140 21.33790
C C39 10.38960 28.02890 20.48020
O O40 8.45580 24.32000 23.02670
O O41 12.11050 27.15470 24.33370
C C42 10.57460 24.00660 27.44530
O O43 9.48920 23.63160 28.41640
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 4.94410 26.62430 29.52020
C C2 3.73330 26.14660 28.51720
C C3 4.21830 24.89390 27.72170
C C4 5.58090 25.35950 27.09110
C C5 6.66640 25.75810 28.20560
O O6 6.15790 27.02640 28.77900
N N7 2.51200 25.79520 29.24920
C C8 1.48670 26.65420 29.47570
O O9 1.54410 27.76160 29.17050
C C10 0.29800 26.04150 30.13970
O O11 3.22370 24.56050 26.73820
C C12 7.99970 26.01240 27.55860
O O13 7.77050 27.05540 26.48880
O O14 6.22660 24.35040 26.25880
C C15 6.57050 24.16510 24.85820
C C16 5.41710 24.05120 23.86570
C C17 5.94300 23.65770 22.52200
C C18 7.20440 24.48450 22.13140
C C19 8.23540 24.66750 23.26440
O O20 7.57970 25.11200 24.45460
N N21 4.51430 22.95810 24.45430
C C22 3.20250 22.85660 24.16790
O O23 2.61150 23.73510 23.71460
C C24 2.60660 21.52470 24.46850
O O25 7.90500 23.80170 21.03790
O O26 4.92000 23.92150 21.54180
C C27 9.24990 25.75070 22.92290
O O28 10.33630 25.25160 22.08510
O O29 4.48430 27.79350 30.29550
C C30 4.45730 31.88010 30.95220
C C31 4.38460 31.52080 29.44640
C C32 4.09230 30.04290 29.29010
C C33 5.09340 29.23830 30.19070
C C34 5.36000 29.78510 31.60040
O O35 5.67790 31.22000 31.46930
N N36 3.35060 32.35150 28.79860
C C37 3.41220 32.75850 27.50660
O O38 4.31340 32.50210 26.84850
C C39 2.22370 33.53580 27.06720
O O40 4.27810 29.58050 27.94420
O O41 4.75770 33.27110 30.98570
C C42 6.54170 29.13630 32.27900
O O43 7.30850 28.20970 31.37620
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 3.35660 27.31270 28.65740
C C2 2.95700 25.72510 28.51430
C C3 4.22190 24.93950 28.04530
C C4 4.68830 25.71880 26.76220
C C5 5.07460 27.24490 27.07990
O O6 3.77770 27.90130 27.36880
N N7 2.49110 25.15340 29.78190
C C8 3.23790 25.10110 30.91330
O O9 4.33770 25.43740 30.93060
C C10 2.51430 24.58240 32.11190
O O11 3.84390 23.57860 27.77530
C C12 5.68800 27.88470 25.86520
O O13 4.66540 28.85830 25.32510
O O14 5.86110 25.14520 26.11150
C C15 7.19220 24.69590 26.48660
C C16 8.29540 24.83420 25.44160
C C17 9.53140 24.13820 25.91570
C C18 9.84680 24.47270 27.40440
C C19 8.62430 24.45470 28.34540
O O20 7.55940 25.22140 27.77770
N N21 7.72030 24.15950 24.18840
C C22 7.31130 24.84840 23.10620
O O23 7.08540 25.97660 23.15570
C C24 7.19970 24.03500 21.86310
O O25 10.79020 23.47900 27.92920
O O26 10.64060 24.59250 25.11560
C C27 8.94140 25.11430 29.68100
O O28 10.12580 24.54420 30.31590
O O29 2.17220 28.05950 29.12560
C C30 4.00240 30.35220 32.04560
C C31 2.85460 29.47770 32.61090
C C32 2.43760 28.45480 31.57470
C C33 2.19620 29.19420 30.21240
C C34 3.21720 30.26780 29.80930
O O35 3.39930 31.16630 30.96550
N N36 3.30520 28.83390 33.86040
C C37 2.56150 28.78570 34.99310
O O38 1.53480 29.28970 35.04800
C C39 3.20620 28.03170 36.10020
O O40 1.21000 27.79230 31.91270
O O41 4.29830 31.28570 33.07860
C C42 2.75710 31.12680 28.65690
O O43 2.90010 30.45200 27.32060
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 3.44620 27.04060 31.07430
C C2 2.76850 26.55020 29.65990
C C3 3.71720 25.50260 28.99670
C C4 5.10700 26.23570 28.95310
C C5 5.64470 26.61540 30.41800
O O6 4.74920 27.70700 30.86820
N N7 1.45280 25.93380 29.85900
C C8 0.27420 26.56000 29.61530
O O9 0.22780 27.66670 29.30540
C C10 -0.93320 25.69680 29.77770
O O11 3.20570 25.18040 27.69200
C C12 7.05130 27.13980 30.33080
O O13 7.96870 25.95680 30.54010
O O14 6.17250 25.45410 28.33530
C C15 6.61460 25.10070 26.99590
C C16 8.02050 24.52490 26.85450
C C17 8.38050 24.41890 25.40670
C C18 7.21950 23.80740 24.56670
C C19 5.81720 24.35490 24.90490
O O20 5.60780 24.32230 26.31880
N N21 8.92060 25.53360 27.58150
C C22 10.16600 25.23790 27.99950
O O23 10.52540 24.14940 28.11110
C C24 11.02110 26.42540 28.27910
O O25 7.44920 24.10030 23.14740
O O26 9.52050 23.54530 25.28760
C C27 4.72130 23.48420 24.30500
O O28 3.50660 23.48180 25.11480
O O29 2.54280 28.01270 31.72120
C C30 3.06530 26.94940 35.68720
C C31 1.80930 26.29480 35.05800
C C32 1.84350 26.47140 33.55420
C C33 2.12350 27.98160 33.23530
C C34 3.19580 28.68680 34.07810
O O35 2.90160 28.40890 35.49710
N N36 1.76340 24.86910 35.43760
C C37 0.73080 24.30140 36.10840
O O38 -0.16320 24.92670 36.45610
C C39 0.88900 22.83900 36.32330
O O40 0.59570 26.13760 32.92850
O O41 2.92240 26.74990 37.08930
C C42 3.19080 30.18740 33.91690
O O43 2.23520 30.66670 32.85930
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 6.41130 26.53010 27.33240
C C2 7.30180 26.45130 28.71130
C C3 6.33480 26.58170 29.92990
C C4 5.52990 27.89730 29.62580
C C5 4.68690 27.79740 28.26250
O O6 5.71160 27.82440 27.19230
N N7 8.03610 25.18700 28.82650
C C8 9.35210 25.04160 28.53100
O O9 9.97260 25.90130 28.08500
C C10 9.91200 23.69160 28.83660
O O11 7.11910 26.66290 31.13240
C C12 3.79590 29.00010 28.11830
O O13 2.41790 28.57550 28.57220
O O14 4.56370 28.25540 30.65840
C C15 3.72890 27.57790 31.63730
C C16 3.92460 27.95660 33.10250
C C17 3.14560 27.02390 33.97440
C C18 1.70230 26.79790 33.43280
C C19 1.60930 26.57890 31.90850
O O20 2.34830 27.59290 31.22310
N N21 5.43470 27.80930 33.33590
C C22 6.08920 28.44270 34.32760
O O23 5.63470 29.35130 34.87010
C C24 7.41820 27.85800 34.66140
O O25 1.13750 25.59800 34.06060
O O26 3.03920 27.61380 35.28490
C C27 0.17440 26.70890 31.41500
O O28 -0.73000 27.19140 32.45430
O O29 7.31540 26.38150 26.17480
C C30 5.97800 24.61520 22.67850
C C31 5.51190 23.85230 23.94440
C C32 5.76710 24.70160 25.17220
C C33 7.24930 25.21320 25.12600
C C34 7.77520 25.71040 23.77180
O O35 7.45500 24.68110 22.76410
N N36 4.08260 23.51070 23.80640
C C37 3.47900 22.50700 24.48970
O O38 4.07450 21.83250 25.19790
C C39 2.02040 22.39620 24.22520
O O40 5.61800 23.96600 26.39560
O O41 5.71870 23.72770 21.59620
C C42 9.27260 25.89710 23.74480
O O43 9.94130 25.51270 25.03580
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 7.68950 26.58500 25.94070
C C2 8.56010 26.63030 27.33370
C C3 7.78210 27.49790 28.37250
C C4 7.51470 28.84390 27.60580
C C5 6.62190 28.63060 26.28800
O O6 7.52070 27.92630 25.34340
N N7 8.77090 25.29420 27.90040
C C8 9.89490 24.91530 28.55880
O O9 10.80850 25.60830 28.64820
C C10 9.83680 23.54540 29.14990
O O11 8.60470 27.66490 29.54000
C C12 6.24140 29.96220 25.70220
O O13 4.77770 29.87190 25.33530
O O14 6.81270 29.84910 28.39610
C C15 5.62910 29.92800 29.23710
C C16 4.44070 30.71780 28.69660
C C17 3.40600 30.86990 29.76600
C C18 3.15070 29.52880 30.51670
C C19 4.42400 28.73570 30.87730
O O20 5.27010 28.62200 29.73050
N N21 5.03510 32.07560 28.29730
C C22 4.47850 32.87570 27.36830
O O23 3.70880 32.47870 26.60910
C C24 4.92850 34.29470 27.42670
O O25 2.46430 29.81140 31.78230
O O26 2.16950 31.27130 29.14400
C C27 4.09130 27.30750 31.28810
O O28 5.16610 26.37220 30.97010
O O29 8.40600 25.74480 24.96080
C C30 5.64070 24.47420 22.15510
C C31 5.43810 23.79950 23.53550
C C32 6.26670 24.51900 24.57930
C C33 7.73250 24.66410 24.03980
C C34 7.89880 25.06990 22.56840
O O35 7.03840 24.18330 21.76150
N N36 4.00200 23.81330 23.87630
C C37 3.39260 22.84820 24.60830
O O38 3.97100 21.93060 24.97500
C C39 1.95350 23.11450 24.86890
O O40 6.34760 23.79680 25.81700
O O41 4.84590 23.71340 21.25210
C C42 9.30770 24.89550 22.05630
O O43 10.34970 25.45410 22.98580
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 5.65510 26.82900 27.35980
C C2 6.44030 26.66750 28.79420
C C3 5.37940 26.67300 29.93950
C C4 4.55410 27.98430 29.67460
C C5 3.82130 27.96800 28.24560
O O6 4.92290 28.10930 27.26450
N N7 7.20780 25.42010 28.86970
C C8 8.55310 25.34350 28.71230
O O9 9.18360 26.26130 28.42400
C C10 9.13000 23.98670 28.94800
O O11 6.06660 26.68170 31.20260
C C12 2.90200 29.15170 28.12440
O O13 1.60130 28.76010 28.78760
O O14 3.50010 28.23130 30.65240
C C15 3.13780 27.78020 31.98640
C C16 2.40870 26.44440 32.09710
C C17 1.93320 26.24240 33.50070
C C18 3.03860 26.59480 34.54070
C C19 3.81930 27.89150 34.24200
O O20 4.26140 27.89360 32.88230
N N21 1.23070 26.57100 31.12100
C C22 1.07060 25.76360 30.05540
O O23 1.93910 25.13410 29.63600
C C24 -0.30980 25.74780 29.49520
O O25 2.41700 26.77740 35.85720
O O26 1.59610 24.85120 33.66750
C C27 5.08270 27.98670 35.08700
O O28 4.84830 28.65110 36.36550
O O29 6.64930 26.79890 26.26880
C C30 5.80070 24.78870 22.75150
C C31 5.39440 23.98020 24.00970
C C32 5.44450 24.87770 25.22860
C C33 6.82670 25.61940 25.24570
C C34 7.33900 26.17390 23.90880
O O35 7.24150 25.09160 22.91050
N N36 4.04720 23.41190 23.80730
C C37 3.53180 22.40960 24.56110
O O38 4.14890 21.91580 25.38950
C C39 2.13460 22.04970 24.20300
O O40 5.34860 24.14630 26.45980
O O41 5.74470 23.85490 21.67870
C C42 8.78680 26.59770 23.95350
O O43 9.36300 26.59370 25.34260
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 6.85310 24.18510 26.85650
C C2 7.65900 25.45210 27.52410
C C3 6.95910 25.82750 28.86820
C C4 5.45320 26.02120 28.46100
C C5 4.80500 24.68110 27.85830
O O6 5.45070 24.52210 26.53400
N N7 9.06420 25.13420 27.79810
C C8 10.08140 26.02500 27.68850
O O9 9.91470 27.09020 27.28790
C C10 11.41030 25.50830 28.13180
O O11 7.56520 27.02550 29.38310
C C12 3.32560 24.86680 27.66320
O O13 2.90360 23.88840 26.59100
O O14 4.58450 26.41430 29.56500
C C15 4.10910 27.64330 30.17980
C C16 2.91370 27.53500 31.12180
C C17 2.43500 28.90310 31.49100
C C18 3.61710 29.84610 31.86640
C C19 4.83930 29.75740 30.92910
O O20 5.20930 28.38990 30.73660
N N21 1.85650 26.77340 30.31030
C C22 0.84310 26.09380 30.87990
O O23 0.86670 25.78860 31.99020
C C24 -0.29340 25.79790 29.96330
O O25 3.15440 31.23760 31.81590
O O26 1.57890 28.78600 32.64430
C C27 6.05920 30.43290 31.54130
O O28 7.09710 29.47600 31.91350
O O29 7.52420 23.80680 25.59710
C C30 7.95960 24.16980 21.49690
C C31 8.76020 25.24410 22.27580
C C32 8.80760 24.87690 23.74450
C C33 7.35000 24.55360 24.22540
C C34 6.47650 23.70680 23.28870
O O35 6.55410 24.30700 21.94300
N N36 10.11410 25.35400 21.69820
C C37 10.80410 26.51810 21.61310
O O38 10.34110 27.50630 21.96000
C C39 12.17000 26.36370 21.04720
O O40 9.29040 25.94850 24.56820
O O41 7.95500 24.61970 20.14650
C C42 5.01860 23.69630 23.67880
O O43 4.64160 22.51640 24.53150
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 7.27800 24.98260 26.57740
C C2 5.71630 24.52680 26.34590
C C3 4.79160 25.54630 27.08260
C C4 5.36070 25.57210 28.54770
C C5 6.88570 26.07250 28.60300
O O6 7.66100 24.96030 28.00480
N N7 5.35030 24.50040 24.92600
C C8 4.74560 23.45080 24.31520
O O9 4.54800 22.46020 24.86540
C C10 4.36260 23.69580 22.89310
O O11 3.43570 25.07280 27.00990
C C12 7.31600 26.25700 30.03190
O O13 7.19400 27.73310 30.33420
O O14 4.62780 26.44820 29.45500
C C15 3.98340 27.75100 29.41220
C C16 3.60410 28.38580 30.74690
C C17 2.77350 29.60660 30.50850
C C18 3.37300 30.50160 29.38280
C C19 3.86850 29.73380 28.13970
O O20 4.70320 28.64390 28.53900
N N21 2.80160 27.29700 31.47270
C C22 2.66920 27.25260 32.81190
O O23 3.37740 27.83310 33.51050
C C24 1.53430 26.41560 33.29230
O O25 2.34240 31.43400 28.91230
O O26 2.74940 30.38080 31.72370
C C27 4.73690 30.61520 27.25190
O O28 4.53430 30.34580 25.83150
O O29 8.15880 24.03810 25.86210
C C30 11.10960 26.70310 24.71160
C C31 10.43870 26.00280 23.50280
C C32 9.18540 25.28680 23.96170
C C33 9.54090 24.41170 25.21420
C C34 10.44910 25.04770 26.27630
O O35 11.61890 25.61670 25.57970
N N36 10.14160 27.00780 22.46340
C C37 10.89700 27.18720 21.35170
O O38 11.85030 26.57660 21.18010
C C39 10.36170 28.21890 20.42500
O O40 8.66000 24.39620 22.96640
O O41 12.27820 27.31790 24.18020
C C42 10.97970 24.05410 27.28080
O O43 9.92210 23.53230 28.21390
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 7.01090 26.81310 26.45670
C C2 7.84470 26.88660 27.87090
C C3 6.90770 27.49040 28.96390
C C4 6.39870 28.82990 28.31770
C C5 5.57410 28.58070 26.96230
O O6 6.59800 28.15020 25.98130
N N7 8.29810 25.56530 28.31740
C C8 9.59740 25.17620 28.34660
O O9 10.44020 25.84430 27.93880
C C10 9.82950 23.83010 28.94940
O O11 7.67350 27.69550 30.16360
C C12 4.95500 29.86770 26.49180
O O13 3.52630 29.86750 26.98580
O O14 5.51270 29.60620 29.17810
C C15 4.54830 29.35940 30.23800
C C16 4.06520 30.56660 31.03650
C C17 3.25210 30.10760 32.20500
C C18 2.22920 29.00490 31.79850
C C19 2.78930 27.91600 30.85990
O O20 3.47520 28.52290 29.76200
N N21 5.35490 31.26300 31.49250
C C22 5.54950 32.59100 31.38430
O O23 4.90730 33.24260 30.68470
C C24 6.63690 33.12770 32.24980
O O25 1.76460 28.31380 33.00660
O O26 2.51000 31.23530 32.70950
C C27 1.67160 27.08720 30.24110
O O28 0.34840 27.62840 30.53670
O O29 7.88170 26.21900 25.42310
C C30 5.75190 24.46120 22.33970
C C31 5.40800 23.85030 23.72180
C C32 5.97700 24.72480 24.81980
C C33 7.48500 25.01250 24.49760
C C34 7.83710 25.34710 23.04110
O O35 7.21770 24.31730 22.18480
N N36 3.94320 23.71190 23.84040
C C37 3.33500 22.74130 24.56600
O O38 3.94520 21.93670 25.10570
C C39 1.85210 22.84560 24.57990
O O40 5.93910 24.09230 26.10760
O O41 5.19830 23.55820 21.38880
C C42 9.31990 25.31290 22.76210
O O43 10.14920 25.07120 23.99310
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 5.18480 25.56350 26.81050
C C2 3.90550 24.63250 27.25460
C C3 2.96140 25.49030 28.15470
C C4 3.91690 26.04310 29.27380
C C5 5.09190 26.96090 28.67690
O O6 5.98230 26.00840 27.97260
N N7 3.14280 24.14920 26.09900
C C8 3.23360 22.89120 25.59930
O O9 3.99050 22.12850 26.00950
C C10 2.27630 22.59130 24.49350
O O11 1.91960 24.64220 28.66750
C C12 5.85690 27.61120 29.79620
O O13 6.24170 26.50860 30.75600
O O14 3.24690 26.86640 30.27450
C C15 2.90170 26.78440 31.68460
C C16 2.16380 25.53270 32.15060
C C17 1.70860 25.71070 33.56410
C C18 2.83270 26.31000 34.46120
C C19 3.61900 27.47410 33.82330
O O20 4.03990 27.11510 32.50500
N N21 0.97190 25.41320 31.19070
C C22 0.01340 26.35360 31.09020
O O23 -0.14340 27.14900 31.90820
C C24 -0.79400 26.28040 29.84030
O O25 2.23310 26.83810 35.69180
O O26 1.36310 24.41570 34.09370
C C27 4.89600 27.77230 34.59760
O O28 5.98520 28.20730 33.72830
O O29 6.07020 24.76750 25.93750
C C30 9.07030 24.72360 23.08620
C C31 9.11560 25.99210 23.97540
C C32 8.20480 25.80710 25.17140
C C33 6.80500 25.31610 24.66140
C C34 6.79810 24.24140 23.56490
O O35 7.71230 24.68870 22.49650
N N36 10.51000 26.24650 24.38740
C C37 11.00960 27.48330 24.63030
O O38 10.36620 28.41950 24.48610
C C39 12.42360 27.47770 25.08890
O O40 7.98130 27.02810 25.89180
O O41 9.93220 25.01010 21.99020
C C42 5.44380 24.04690 22.92780
O O43 5.32000 24.71070 21.58400
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 5.43180 27.55480 28.09110
C C2 6.91350 27.75880 27.41050
C C3 7.05020 26.75840 26.21970
C C4 6.69990 25.36700 26.86180
C C5 5.20570 25.32290 27.44910
O O6 5.25350 26.19630 28.64530
N N7 7.10960 29.12140 26.90510
C C8 8.29450 29.78140 26.93570
O O9 9.22480 29.33500 27.44370
C C10 8.28230 31.11200 26.25840
O O11 8.39460 26.82650 25.71410
C C12 4.86160 23.92320 27.87760
O O13 3.49740 23.61710 27.30290
O O14 6.78950 24.24460 25.93440
C C15 6.93140 24.03610 24.50240
C C16 5.65350 24.02830 23.66850
C C17 5.96420 23.59610 22.27080
C C18 7.23190 24.31080 21.71420
C C19 8.41310 24.39760 22.70290
O O20 7.95880 24.89260 23.96490
N N21 4.74230 23.01600 24.37670
C C22 3.42160 22.92090 24.13230
O O23 2.83860 23.76830 23.61420
C C24 2.80450 21.63700 24.56840
O O25 7.72230 23.57400 20.54400
O O26 4.84980 23.95310 21.42950
C C27 9.46580 25.38900 22.22530
O O28 10.43510 24.77880 21.32020
O O29 5.28410 28.51530 29.20250
C C30 3.00920 30.09970 32.27610
C C31 2.82050 28.56880 32.12680
C C32 3.88860 28.01220 31.20850
C C33 3.92480 28.87960 29.90190
C C34 3.82810 30.40260 30.07100
O O35 2.67950 30.68090 30.95450
N N36 2.86970 27.94120 33.46190
C C37 2.18270 26.82000 33.79260
O O38 1.48150 26.31360 33.04230
C C39 2.44070 26.34730 35.17820
O O40 3.62300 26.66080 30.80450
O O41 1.95070 30.52070 33.12950
C C42 3.56930 31.13210 28.77540
O O43 3.14070 30.22160 27.65790
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 4.54210 27.63450 27.82710
C C2 6.13730 27.88470 27.52220
C C3 6.58730 26.88990 26.40640
C C4 6.13480 25.48790 26.95470
C C5 4.54520 25.39700 27.16480
O O6 4.27670 26.27070 28.33130
N N7 6.40810 29.25320 27.06970
C C8 6.99360 30.20670 27.83680
O O9 7.24930 30.02300 28.94310
C C10 7.27530 31.48940 27.12640
O O11 8.01120 27.00000 26.23930
C C12 4.15050 23.98710 27.50730
O O13 2.67570 23.86300 27.19970
O O14 6.47940 24.36940 26.08390
C C15 6.72710 24.13870 24.66980
C C16 5.51090 24.06460 23.75140
C C17 5.93300 23.61770 22.38790
C C18 7.20820 24.37030 21.90320
C C19 8.31450 24.52250 22.96770
O O20 7.75620 25.02390 24.18450
N N21 4.59190 23.03160 24.41830
C C22 3.28520 22.90900 24.11720
O O23 2.70700 23.74510 23.57590
C C24 2.67740 21.61130 24.52450
O O25 7.80530 23.63040 20.78560
O O26 4.86650 23.91430 21.46520
C C27 9.35950 25.54480 22.54080
O O28 10.35510 24.97830 21.63580
O O29 4.10180 28.58920 28.86350
C C30 2.86880 29.45870 32.71790
C C31 4.31290 28.89850 32.66930
C C32 4.80710 28.89080 31.23750
C C33 3.72090 28.20330 30.33850
C C34 2.25550 28.57710 30.60340
O O35 2.01700 28.44560 32.05360
N N36 5.18030 29.71610 33.53990
C C37 6.23100 29.21800 34.23740
O O38 6.47960 28.10060 34.21400
C C39 6.98790 30.24860 34.99570
O O40 6.01960 28.14050 31.07380
O O41 2.49590 29.39950 34.09030
C C42 1.27200 27.66280 29.91450
O O43 1.84860 26.31410 29.58260
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 3.97710 28.36680 29.30820
C C2 3.58360 27.03080 28.43610
C C3 4.89150 26.44300 27.81880
C C4 5.53340 27.66880 27.07300
C C5 5.88980 28.87470 28.07200
O O6 4.57300 29.42690 28.46830
N N7 2.94640 25.99800 29.25950
C C8 3.53770 25.40210 30.32530
O O9 4.63120 25.61590 30.61050
C C10 2.65490 24.46580 31.08250
O O11 4.53870 25.36420 26.93590
C C12 6.66680 29.93560 27.34270
O O13 5.96370 30.15770 26.02310
O O14 6.77660 27.35670 26.37660
C C15 7.80170 26.32590 26.40720
C C16 8.04480 25.54530 25.11880
C C17 8.96940 24.40080 25.38760
C C18 10.18800 24.83530 26.25590
C C19 9.84090 25.75380 27.44590
O O20 9.01170 26.83190 27.00530
N N21 6.65180 25.05230 24.70310
C C22 6.35080 24.67860 23.44500
O O23 7.00920 24.97970 22.54940
C C24 5.12380 23.84190 23.32690
O O25 10.82170 23.64010 26.82400
O O26 9.47380 23.92180 24.12540
C C27 11.08870 26.40400 28.02840
O O28 11.78180 25.53200 28.97190
O O29 2.74870 28.91460 29.91700
C C30 3.87200 28.84580 33.90020
C C31 2.48180 28.20260 33.66480
C C32 2.26750 27.98430 32.18140
C C33 2.59710 29.32000 31.42770
C C34 3.84760 30.08760 31.87980
O O35 3.78440 30.21720 33.34830
N N36 2.39890 26.93640 34.41880
C C37 1.32700 26.57370 35.16580
O O38 0.42490 27.26930 35.28180
C C39 1.45570 25.22720 35.78230
O O40 0.90930 27.64900 31.86110
O O41 3.96030 29.02880 35.30900
C C42 3.92380 31.48730 31.32070
O O43 3.11680 31.66870 30.06480
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 7.07950 26.75110 26.71790
C C2 8.07630 27.21080 27.94080
C C3 7.19730 27.69300 29.13750
C C4 6.24940 28.76820 28.49220
C C5 5.31800 28.14970 27.33930
O O6 6.25060 27.86980 26.22210
N N7 8.93470 26.11380 28.39950
C C8 8.47700 24.88820 28.75870
O O9 7.35270 24.64960 28.80370
C C10 9.54510 23.89530 29.07880
O O11 8.06000 28.23460 30.15250
C C12 4.30770 29.16900 26.89080
O O13 3.14340 29.07660 27.85040
O O14 5.33530 29.39920 29.43780
C C15 5.03540 29.33080 30.85890
C C16 4.47850 28.01390 31.39190
C C17 4.03550 28.18890 32.80970
C C18 5.09110 28.96560 33.65230
C C19 5.70360 30.19500 32.94960
O O20 6.13850 29.84010 31.63470
N N21 3.29140 27.70120 30.47030
C C22 2.80530 26.45770 30.29600
O O23 3.41600 25.52310 30.57890
C C24 1.42680 26.40740 29.73310
O O25 4.45510 29.46110 34.87820
O O26 3.87460 26.88280 33.39690
C C27 6.94750 30.68820 33.67670
O O28 7.11150 30.06310 34.98580
O O29 7.90240 26.26910 25.59100
C C30 5.82750 24.52980 22.46010
C C31 5.46340 23.90690 23.83170
C C32 6.01210 24.77430 24.94550
C C33 7.52420 25.06890 24.64970
C C34 7.89850 25.41610 23.20170
O O35 7.29590 24.39140 22.32750
N N36 3.99740 23.76320 23.92570
C C37 3.38060 22.76910 24.61110
O O38 3.98460 21.94790 25.13270
C C39 1.89760 22.87140 24.60820
O O40 5.95560 24.13150 26.22750
O O41 5.29190 23.63270 21.49340
C C42 9.38570 25.38840 22.94620
O O43 10.19490 25.11770 24.18460
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 6.79150 26.70160 26.31200
C C2 7.57170 26.89970 27.74460
C C3 6.59150 27.58420 28.74860
C C4 6.09940 28.86090 27.97470
C C5 5.32700 28.49270 26.61560
O O6 6.38900 27.99100 25.71200
N N7 8.01560 25.62410 28.31610
C C8 9.31600 25.28410 28.50050
O O9 10.17610 25.95670 28.13920
C C10 9.52450 23.98500 29.20630
O O11 7.31110 27.89500 29.95410
C C12 4.71870 29.73070 26.01700
O O13 4.83640 29.58960 24.51660
O O14 5.17780 29.69840 28.73440
C C15 5.21110 30.54070 29.91920
C C16 4.00790 31.44610 30.16550
C C17 4.30170 32.38190 31.29460
C C18 4.95850 31.64400 32.49950
C C19 6.06040 30.63380 32.11790
O O20 5.59390 29.77190 31.07690
N N21 3.82510 32.20530 28.84390
C C22 2.67870 32.18430 28.13790
O O23 1.87600 31.37640 28.30950
C C24 2.54230 33.29100 27.14990
O O25 5.58830 32.63320 33.38140
O O26 3.05630 32.94790 31.74780
C C27 6.40560 29.72040 33.28650
O O28 7.35650 30.33290 34.20950
O O29 7.70330 26.03120 25.36410
C C30 5.47700 24.44290 22.25700
C C31 5.19890 23.73610 23.60780
C C32 5.79860 24.54630 24.73830
C C33 7.28770 24.88150 24.37660
C C34 7.57520 25.31770 22.93290
O O35 6.93730 24.33580 22.03500
N N36 3.74240 23.56390 23.77470
C C37 3.18190 22.61080 24.55950
O O38 3.82910 21.84770 25.11610
C C39 1.69770 22.67590 24.61170
O O40 5.82270 23.82960 25.98160
O O41 4.89910 23.59480 21.27070
C C42 9.04580 25.32850 22.59390
O O43 9.89730 24.64320 23.62680
# CIF file generated by openbabel 2.3.2, see http://openbabel.sf.net
data_I
_chemical_name_common '*****'
loop_
_atom_site_type_symbol
_atom_site_label
_atom_site_Cartn_x
_atom_site_Cartn_y
_atom_site_Cartn_z
C C1 3.57040 27.60110 29.34420
C C2 3.23070 25.99920 29.20680
C C3 4.38250 25.31910 28.40160