IBS-ZINC00006582 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 0.1000 1.4990 0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5360 0.0560 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3420 -0.5580 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 -0.3380 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -1.8240 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2450 -2.2690 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0490 -1.8240 -1.4850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1510 -2.2150 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.3320 -1.3500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 0.6050 -2.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 1.8200 -2.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 0.1030 -3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 1.2430 -4.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 0.6040 -5.6740 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 2.0990 -6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3390 3.1740 -5.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 1.9330 -7.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -2.4810 -2.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -3.1900 -3.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 2.2010 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 1.8030 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 1.5990 1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 0.2690 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -0.1320 2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9720 -2.0290 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.4290 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1700 -1.8310 -1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3650 -3.3580 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -0.6560 -3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -0.3260 -4.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1260 2.0000 -4.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 1.7250 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 1.2440 -7.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 1.5680 -8.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6730 2.9030 -7.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -2.2390 -3.4630 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 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 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 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 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 M CHG 1 36 -1 M END