CCI Converted by convert_cif2sdf.py 2020/07/03 05:37:52 120124 0 0 0 0 0 0 0 0999 V2000 -8.9810 -0.3690 -0.8800 C 0 0 0 0 0 -10.3920 -0.8210 -0.4930 C 0 0 0 0 0 -11.0190 0.2250 0.4340 C 0 0 0 0 0 -11.0180 1.5840 -0.2730 C 0 0 0 0 0 -9.5830 1.9430 -0.6670 C 0 0 0 0 0 -9.5800 3.2720 -1.4270 C 0 0 0 0 0 -8.1700 -0.2870 0.2930 O 0 0 0 0 0 -11.1900 -0.9550 -1.6710 O 0 0 0 0 0 -12.3630 -0.1530 0.7400 O 0 0 0 0 0 -11.5340 2.5820 0.6100 O 0 0 0 0 0 -9.0490 0.9150 -1.5040 O 0 0 0 0 0 -12.4850 -0.9730 1.9040 C 0 0 0 0 0 -5.9470 0.5140 0.0060 C 0 0 0 0 0 -6.8440 -0.5400 0.1450 C 0 0 0 0 0 -6.3870 -1.8540 0.1310 C 0 0 0 0 0 -5.0320 -2.1150 -0.0200 C 0 0 0 0 0 -4.1300 -1.0510 -0.1590 C 0 0 0 0 0 -4.6020 0.2660 -0.1450 C 0 0 0 0 0 -6.6490 2.4880 0.0190 I 0 0 0 0 0 -7.2680 -2.8820 0.2670 O 0 0 0 0 0 -7.4590 -3.4030 1.5840 C 0 0 0 0 0 -4.5830 -3.3960 -0.0330 O 0 0 0 0 0 -4.4300 -4.0170 -1.3110 C 0 0 0 0 0 -3.6360 1.4130 -0.2940 C 0 0 0 0 0 -2.6900 -1.3190 -0.3200 C 0 0 0 0 0 -2.2190 -1.4620 -1.4330 O 0 0 0 0 0 -1.6510 -1.4310 1.0980 S 0 0 0 0 0 2.7300 -0.8170 0.1050 C 0 0 0 0 0 1.7390 -0.4200 -0.9920 C 0 0 0 0 0 0.3410 -0.2850 -0.3820 C 0 0 0 0 0 -0.0390 -1.6060 0.2940 C 0 0 0 0 0 1.0200 -1.9570 1.3420 C 0 0 0 0 0 0.6800 -3.3050 1.9810 C 0 0 0 0 0 4.0270 -1.0000 -0.4660 O 0 0 0 0 0 0.3410 0.7660 0.5860 O 0 0 0 0 0 2.3010 -2.0370 0.7140 O 0 0 0 0 0 9.1960 -1.6960 -0.0110 C 0 0 0 0 0 8.8280 -0.2280 -0.2410 C 0 0 0 0 0 7.4610 0.0530 0.3930 C 0 0 0 0 0 6.4270 -0.9060 -0.2050 C 0 0 0 0 0 6.8880 -2.3480 0.0230 C 0 0 0 0 0 5.8900 -3.3110 -0.6240 C 0 0 0 0 0 10.4430 -1.9800 -0.6470 O 0 0 0 0 0 9.8150 0.6120 0.3620 O 0 0 0 0 0 7.0760 1.4020 0.1200 O 0 0 0 0 0 5.1280 -0.6970 0.4480 N 0 0 0 0 0 8.1780 -2.5330 -0.5640 O 0 0 0 0 0 10.9360 -3.2980 -0.3990 C 0 0 0 0 0 10.0850 1.8090 -0.3700 C 0 0 0 0 0 10.9050 2.7650 0.5000 C 0 0 0 0 0 12.2490 2.1120 0.8350 C 0 0 0 0 0 12.9680 1.7510 -0.4690 C 0 0 0 0 0 12.0680 0.8340 -1.3010 C 0 0 0 0 0 13.0510 3.0270 1.5850 O 0 0 0 0 0 12.8730 2.9300 3.0000 C 0 0 0 0 0 14.2250 1.0570 -0.1600 N 0 0 0 0 0 15.1950 1.2140 -1.2530 C 0 0 0 0 0 16.4880 0.4790 -0.8960 C 0 0 0 0 0 10.8230 1.4900 -1.5510 O 0 0 0 0 0 -8.5460 -1.0880 -1.5730 H 0 0 0 0 0 -10.3390 -1.7800 0.0220 H 0 0 0 0 0 -10.4390 0.2910 1.3540 H 0 0 0 0 0 -11.6390 1.5310 -1.1670 H 0 0 0 0 0 -8.9710 2.0360 0.2300 H 0 0 0 0 0 -9.8970 4.0730 -0.7590 H 0 0 0 0 0 -8.5740 3.4800 -1.7910 H 0 0 0 0 0 -10.2670 3.2090 -2.2710 H 0 0 0 0 0 -10.8480 -1.5980 -2.3070 H 0 0 0 0 0 -11.5620 3.4690 0.2280 H 0 0 0 0 0 -11.9170 -1.8930 1.7620 H 0 0 0 0 0 -12.0960 -0.4360 2.7700 H 0 0 0 0 0 -13.5350 -1.2170 2.0690 H 0 0 0 0 0 -8.1150 -4.2720 1.5400 H 0 0 0 0 0 -6.4960 -3.6960 2.0030 H 0 0 0 0 0 -7.9110 -2.6380 2.2150 H 0 0 0 0 0 -4.1510 -5.0620 -1.1760 H 0 0 0 0 0 -5.3720 -3.9610 -1.8570 H 0 0 0 0 0 -3.6520 -3.5030 -1.8740 H 0 0 0 0 0 -3.2830 1.7220 0.6900 H 0 0 0 0 0 -2.7880 1.0980 -0.9020 H 0 0 0 0 0 -4.1390 2.2500 -0.7790 H 0 0 0 0 0 2.7720 -0.0300 0.8590 H 0 0 0 0 0 2.0400 0.5320 -1.4280 H 0 0 0 0 0 1.7270 -1.1880 -1.7660 H 0 0 0 0 0 -0.3790 -0.0580 -1.1690 H 0 0 0 0 0 -0.0890 -2.3970 -0.4540 H 0 0 0 0 0 1.0400 -1.1850 2.1120 H 0 0 0 0 0 0.7430 -4.0900 1.2270 H 0 0 0 0 0 1.3850 -3.5150 2.7840 H 0 0 0 0 0 -0.3320 -3.2700 2.3850 H 0 0 0 0 0 0.5800 1.6310 0.2280 H 0 0 0 0 0 9.2820 -1.8860 1.0590 H 0 0 0 0 0 8.7810 -0.0270 -1.3110 H 0 0 0 0 0 7.5200 -0.1000 1.4700 H 0 0 0 0 0 6.3330 -0.7190 -1.2750 H 0 0 0 0 0 6.9430 -2.5470 1.0930 H 0 0 0 0 0 5.8350 -3.1120 -1.6940 H 0 0 0 0 0 6.2190 -4.3380 -0.4610 H 0 0 0 0 0 4.9060 -3.1690 -0.1770 H 0 0 0 0 0 7.6260 2.0640 0.5600 H 0 0 0 0 0 5.0520 0.2430 0.8070 H 0 0 0 0 0 11.8860 -3.4340 -0.9160 H 0 0 0 0 0 11.0830 -3.4350 0.6730 H 0 0 0 0 0 10.2150 -4.0300 -0.7640 H 0 0 0 0 0 9.1440 2.2850 -0.6470 H 0 0 0 0 0 11.0760 3.6950 -0.0430 H 0 0 0 0 0 10.3620 2.9750 1.4220 H 0 0 0 0 0 12.0800 1.2090 1.4200 H 0 0 0 0 0 13.1810 2.6600 -1.0310 H 0 0 0 0 0 12.5560 0.6080 -2.2490 H 0 0 0 0 0 11.8880 -0.0920 -0.7550 H 0 0 0 0 0 13.5160 3.6560 3.4970 H 0 0 0 0 0 11.8320 3.1350 3.2500 H 0 0 0 0 0 13.1360 1.9250 3.3310 H 0 0 0 0 0 14.6110 1.3790 0.7150 H 0 0 0 0 0 14.7800 0.7950 -2.1700 H 0 0 0 0 0 15.4070 2.2730 -1.4000 H 0 0 0 0 0 17.2080 0.5950 -1.7060 H 0 0 0 0 0 16.9030 0.8980 0.0220 H 0 0 0 0 0 16.2760 -0.5800 -0.7480 H 0 0 0 0 0 1 2 1 0 0 0 1 7 1 0 0 0 1 11 1 0 0 0 1 60 1 0 0 0 2 3 1 0 0 0 2 8 1 0 0 0 2 61 1 0 0 0 3 4 1 0 0 0 3 9 1 0 0 0 3 62 1 0 0 0 4 5 1 0 0 0 4 10 1 0 0 0 4 63 1 0 0 0 5 6 1 0 0 0 5 11 1 0 0 0 5 64 1 0 0 0 6 65 1 0 0 0 6 66 1 0 0 0 6 67 1 0 0 0 7 14 1 0 0 0 8 68 1 0 0 0 9 12 1 0 0 0 10 69 1 0 0 0 12 70 1 0 0 0 12 71 1 0 0 0 12 72 1 0 0 0 13 14 2 0 0 0 13 18 1 0 0 0 13 19 1 0 0 0 14 15 1 0 0 0 15 16 2 0 0 0 15 20 1 0 0 0 16 17 1 0 0 0 16 22 1 0 0 0 17 18 2 0 0 0 17 25 1 0 0 0 18 24 1 0 0 0 20 21 1 0 0 0 21 73 1 0 0 0 21 74 1 0 0 0 21 75 1 0 0 0 22 23 1 0 0 0 23 76 1 0 0 0 23 77 1 0 0 0 23 78 1 0 0 0 24 79 1 0 0 0 24 80 1 0 0 0 24 81 1 0 0 0 25 26 2 0 0 0 25 27 1 0 0 0 27 31 1 0 0 0 28 29 1 0 0 0 28 34 1 0 0 0 28 36 1 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