OTAVA-ZINC05374829 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 1.0700 1.5530 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 0.3870 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -0.8150 -1.3320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2990 -1.1360 -1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -1.9440 -0.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -2.0870 -1.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3190 -0.5170 -2.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 0.0090 -3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 0.3060 -3.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 0.2200 -4.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3100 0.5260 -6.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -0.5290 -6.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -1.7190 -6.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -0.0220 -7.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -0.8480 -8.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 -0.4260 -9.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4690 -0.4670 -9.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 -0.0520 -10.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 0.4010 -12.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 0.4390 -12.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 0.0260 -11.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 1.6950 -7.9630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 1.8000 -6.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 3.2660 -5.8680 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 1.2300 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 2.0180 -1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 2.3240 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 0.0790 0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 0.7450 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -0.7790 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -0.6960 -5.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2170 1.0320 -4.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.9260 -8.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 -0.8140 -8.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3470 -0.0800 -10.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 0.7260 -12.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8200 0.7920 -13.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4010 0.0640 -11.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5760 0.2820 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 39 -1 M END