IBS-ZINC01896822 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.1060 1.5400 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 0.1180 0.1320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4390 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 0.2510 -2.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -0.4520 -3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -1.8600 -3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -2.5520 -2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -1.8360 -1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -2.5320 0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 0.3230 -4.3990 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9520 1.3730 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 0.2300 -4.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -0.3520 -5.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 -0.6620 -6.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -1.1930 -7.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -0.2220 -5.6940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5060 -0.2850 -6.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -1.0440 -7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -1.1500 -7.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1850 -0.4820 -6.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 0.3030 -5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5110 0.3950 -5.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9230 -0.6070 -7.4070 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 0.7910 -7.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8540 -1.2000 -8.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 -1.5330 -6.3080 N 0 5 0 0 0 0 0 0 0 0 0 0 -4.5710 -1.0200 -5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4330 -0.6380 -6.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 0.6240 -3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -0.0710 -3.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3690 1.8600 -2.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.8430 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 2.9880 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7950 4.1500 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 4.1730 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 3.0300 -3.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1110 1.9730 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 1.9390 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 1.8240 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 1.3360 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -2.4310 -4.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -3.6370 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -1.8450 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.5990 -7.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4630 -1.7600 -8.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 0.8340 -5.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 1.0230 -4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 -1.0990 -6.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 0.9400 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 2.9750 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 5.0430 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 5.0860 -3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9010 3.0790 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 28 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 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 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 46 1 0 0 0 0 22 47 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 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 49 1 0 0 0 0 33 34 1 0 0 0 0 33 50 1 0 0 0 0 34 35 2 0 0 0 0 34 51 1 0 0 0 0 35 36 1 0 0 0 0 35 52 1 0 0 0 0 36 53 1 0 0 0 0 M CHG 1 26 -1 M END