IBS-ZINC04312189 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.2980 1.6320 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 0.8840 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 0.8480 0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 0.1570 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -0.5000 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -0.4720 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 0.2260 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 0.2640 -2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -0.3270 -3.9860 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7960 0.6970 -4.9330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7230 0.2940 -5.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 0.9370 -6.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 0.2110 -5.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 0.2280 -6.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.6200 -4.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -1.3760 -4.1950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 1.8540 -7.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 3.2280 -6.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 3.5940 -7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 4.8680 -6.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 5.7240 -6.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 5.3420 -5.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 4.1400 -6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 1.9800 -4.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 2.3410 -3.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 3.5180 -3.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 4.3350 -2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 3.9740 -3.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 2.7940 -3.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 0.7720 -2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 0.1240 1.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -0.6040 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 0.9350 0.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 2.1110 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 2.3910 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 1.3570 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -1.0360 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -0.9840 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 1.4960 -8.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 1.9030 -7.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 2.9040 -7.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1730 5.1870 -6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 6.7180 -5.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 3.8640 -5.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1920 1.7030 -4.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 3.8000 -2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 5.2550 -2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 4.6120 -2.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 2.5100 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 -1.2330 -3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7810 -0.1710 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -1.6460 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1140 -0.5510 1.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 36 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 2 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 9 50 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 24 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 31 32 1 0 0 0 0 32 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 M END