OTAVA-ZINC01805172 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.6360 1.7080 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 0.2830 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -0.1790 0.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2220 0.5120 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 -1.5550 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1520 -1.9710 -0.7800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 -0.0570 1.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7870 0.9210 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8650 1.8110 0.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6850 0.8080 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 1.4410 2.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 2.3200 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3810 3.3640 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 3.9200 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3010 3.1900 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 2.2160 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3710 3.2250 -1.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 2.4910 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5340 2.5250 -3.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5080 3.2940 -4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 4.0270 -3.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3440 3.9970 -2.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6130 4.9800 -4.3880 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 -0.3460 3.4990 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -0.8510 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -2.1010 2.7980 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 2.0090 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 2.4120 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 1.7980 1.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 0.2340 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -0.3870 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 1.2580 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6230 3.6880 3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5500 4.7530 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 1.8870 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8230 1.9480 -4.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 3.3180 -5.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0640 4.5750 -1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.0860 -0.9780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 39 -1 M END