IBS-ZINC02120702 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.2980 -2.9160 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 -2.2980 -1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 -0.1210 -1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 0.9470 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 0.5150 0.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9720 1.1700 1.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.2540 -2.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 1.2090 -2.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 2.0990 -3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 3.5420 -3.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 4.3050 -4.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 3.9820 -2.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 3.0700 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 1.6980 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 0.8760 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 1.4160 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2870 2.7910 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 3.6210 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 3.4380 0.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 2.6330 1.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -2.4940 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -2.7750 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -3.9950 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 -2.5660 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -2.6390 -2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 0.2700 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -0.8860 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 1.0610 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8680 1.9150 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -0.8460 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.4800 -3.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2820 1.8060 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -0.2040 -1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 0.7290 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 4.6950 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6830 1.9470 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 2.0900 2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8050 3.2990 1.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -0.7880 -1.6140 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4670 -0.4880 -0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 39 1 M END