IBS-ZINC02123988 MOE2007 3D Structure written by MMmdl. 61 63 0 0 1 0 0 0 0 0999 V2000 4.1540 0.4450 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 0.4690 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 1.1010 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6040 -0.9600 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 1.2510 -0.6360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 0.8260 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -0.1700 -1.2730 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 1.5060 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 1.0450 0.0250 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0240 -0.0450 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 1.5960 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 1.0010 -2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 1.6550 -3.9390 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0620 0.8630 -5.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 1.5330 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 2.1990 2.0770 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 1.2290 1.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 1.6120 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7390 0.6700 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2860 1.0500 4.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 2.3880 5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 2.8350 6.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4350 2.0540 7.2630 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5780 4.2060 6.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 5.0420 5.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 4.6230 4.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 3.3360 4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 2.9370 2.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 6.4690 5.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2720 6.9360 6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 8.2710 6.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 9.1430 5.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8150 8.6860 4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 7.3550 4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4760 0.1340 5.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 1.4630 -3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8750 -0.1420 -3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1660 -0.0050 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2480 1.1180 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6750 0.5140 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9280 2.1190 -1.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -1.4100 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 -1.5470 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 -0.9430 0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 2.3010 0.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7690 1.3270 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 2.6810 -1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 1.2700 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.0840 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 1.1350 -5.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.2190 -5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 1.1980 -6.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -0.3600 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 4.5830 7.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 3.6590 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4530 6.2550 7.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0320 8.6350 7.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6330 10.1860 5.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6420 9.3720 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 6.9990 3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3380 -0.3040 5.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 41 1 0 0 0 0 4 42 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 14 52 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 18 19 1 0 0 0 0 18 28 2 0 0 0 0 19 20 2 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 27 2 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 M END