IBS-ZINC02361673 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.5840 1.8220 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 0.3190 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -0.3400 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -1.7190 1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 -2.4490 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -1.8030 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.4090 -1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 0.2900 -2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 0.0640 -3.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 0.9320 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 1.6620 -3.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8820 1.2510 -2.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 2.6610 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 3.3790 -3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 4.4950 -4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 5.1360 -3.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 2.9640 -2.1130 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 2.4450 -2.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 2.1200 -1.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2180 1.6940 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3610 1.7810 -1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4410 1.8820 -2.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 2.3190 -3.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 1.3500 -0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -4.1800 0.2530 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 2.1130 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 2.1920 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 2.2460 0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 0.2230 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -2.2300 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -2.3720 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 -0.6510 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 1.0160 -5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4300 2.8560 -5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0960 2.2110 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0790 0.5900 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0470 0.9390 0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 4.8140 -5.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 5.5640 -6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 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 33 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 38 39 1 0 0 0 0 M END