IBS-ZINC02223812 MOE2007 3D Structure written by MMmdl. 55 58 0 0 0 0 0 0 0 0999 V2000 3.4310 3.3480 1.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4320 2.0120 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 1.2680 0.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 0.0340 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4490 -0.4390 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 0.3220 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6010 1.5430 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0480 2.4980 0.2390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 -1.7510 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -2.2170 -1.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -2.4700 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 -1.8990 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -0.7030 0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2210 -2.6250 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 -3.7110 -1.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -2.0810 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5400 -2.7190 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7060 -1.9680 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -2.6010 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9960 -3.9820 -0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -4.7340 -0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -4.1070 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 -4.7870 -0.3470 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.4510 -3.8660 -0.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3170 -6.0820 -0.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1030 -5.0070 1.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7650 -6.2330 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9200 -3.9750 1.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3790 -4.3090 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0700 -3.8350 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4070 -4.1460 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0560 -4.9210 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3670 -5.3900 2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0280 -5.0840 2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 4.1300 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 3.3370 2.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 3.5440 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 1.6440 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5250 -0.0420 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0500 -3.4370 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -1.2470 0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -0.8890 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -2.0170 -0.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8940 -5.8120 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -4.6940 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -6.0880 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5610 -6.4670 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6510 -7.0550 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6820 -3.9330 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7110 -3.0080 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5640 -3.2260 -0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9450 -3.7800 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1020 -5.1610 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8740 -5.9960 3.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4900 -5.4500 3.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 13 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 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 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 M END