IBS-ZINC01749971 MOE2007 3D Structure written by MMmdl. 62 65 0 0 1 0 0 0 0 0999 V2000 -1.4520 -0.9070 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5320 -0.3170 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 0.8090 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 1.2470 -1.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5350 2.2580 -2.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 0.4150 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 0.7490 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0410 -0.0620 -2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0450 -1.2040 -1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9010 -1.5260 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -0.7170 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -1.0920 0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0850 -2.0790 -1.2340 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2800 -1.7950 -1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3530 -2.8410 -1.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2080 -3.7690 -0.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5050 -2.6190 -2.3730 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.7330 -3.4260 -2.3120 C 0 0 3 0 0 0 0 0 0 0 0 0 -12.8840 -3.7490 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6950 -4.6310 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6850 -5.6950 -2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8300 -7.1730 -3.9000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.5360 -8.1750 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9490 -2.5640 -2.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6130 -1.5080 -3.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 1.6100 -0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 1.4520 -1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 2.1960 -1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 3.1210 -0.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 3.2860 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 2.5240 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 4.1000 1.3230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 5.4740 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 5.8190 0.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 5.1780 -0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 3.7600 -0.8210 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 -0.8800 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 -1.9530 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -0.3950 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 1.6370 -2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9040 0.2270 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -2.4140 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6830 -0.8210 -1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0890 -1.8100 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6100 -1.8180 -3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6940 -5.0860 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4610 -4.2890 -4.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6640 -5.3170 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8600 -5.9920 -1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4700 -9.1360 -3.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5680 -7.6720 -3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7710 -8.3630 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 0.7430 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 2.0530 -2.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 2.6470 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 5.7490 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 6.0570 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 6.9070 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7290 5.4670 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4870 5.4520 -1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 5.5560 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.0900 -3.0030 -2.4650 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 62 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 35 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 36 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M CHG 1 62 -1 M END