IBS-ZINC06760298 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 0.0730 1.4440 -0.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 0.0490 -0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -0.6540 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 0.0960 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9800 1.4910 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 2.1690 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1030 2.3890 1.7310 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -2.1040 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -2.8260 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -2.3070 0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -4.2500 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -4.8960 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 -6.3320 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -6.6550 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -5.2930 -0.2020 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -8.0380 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -9.0620 -0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -8.8130 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 -7.4280 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 -4.1230 -0.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -2.7090 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5430 -2.0390 -0.2620 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 -4.7230 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -5.0730 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9600 -4.4170 2.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 1.9600 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -0.4760 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -0.3990 1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 3.2520 0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -8.2780 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -8.1030 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -10.0730 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -9.0000 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -8.8920 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -9.5870 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -7.4640 -1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -7.2270 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9350 -5.5880 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 -4.0230 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3160 -5.9940 1.3040 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 8 9 1 0 0 0 0 8 21 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 15 1 0 0 0 0 12 13 1 0 0 0 0 12 20 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 M CHG 1 40 -1 M END