IBS-ZINC02388579 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -1.2520 1.1960 -0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5780 -0.1500 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -0.8490 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -2.0840 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -2.6240 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -1.9290 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.6910 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0120 -2.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.6520 -3.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -1.8650 -3.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 0.1120 -4.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -1.0530 -6.2590 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 0.0790 -7.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 1.3920 -7.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 1.9070 -8.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 0.9560 -9.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4520 -0.2440 -8.9290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.5870 -9.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -2.0730 -9.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -2.4720 -11.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 1.1390 -11.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 2.4270 -11.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 2.5810 -12.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 1.4430 -13.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 0.1970 -13.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 0.0760 -11.8590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 -2.9600 2.6850 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.9780 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 1.3530 -1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 1.2320 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.4300 2.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -3.5880 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -2.3500 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1270 0.9770 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 0.7270 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0290 0.7510 -4.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 -1.5570 -10.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.2660 -8.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -2.0910 -9.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -2.4540 -11.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -2.8200 -11.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 3.2910 -10.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 3.5650 -13.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 1.5310 -14.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -0.6900 -13.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 M END