NCID-ZINC05011648 MOE2007 3D Structure written by MMmdl. 45 46 0 0 0 0 0 0 0 0999 V2000 1.0890 -0.5570 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3900 -1.7660 2.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8810 0.5330 2.2320 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 1.7120 1.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 2.7480 1.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 2.7350 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 2.0740 1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 4.0270 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 4.9280 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 6.1030 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 6.3870 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 5.4950 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 4.3160 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 7.5500 -0.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 8.4720 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 8.1770 -2.6010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 9.6820 -1.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 10.7680 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 10.7130 -3.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 11.8350 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 13.0190 -3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 13.0790 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 11.9580 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 -1.9090 3.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -2.5720 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 0.4120 2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9280 3.7570 2.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5150 2.2150 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6610 2.0970 2.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4610 1.0290 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8290 2.5850 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 4.7440 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 6.7910 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 5.6920 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 3.6380 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 7.7450 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 9.8180 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 9.8040 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 11.7770 -5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 13.8870 -4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 13.9970 -2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 12.0380 -0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 -1.1790 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.4200 1.1930 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1700 0.5090 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 44 2 0 0 0 0 2 24 1 0 0 0 0 2 25 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 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END