IBS-ZINC05572691 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -5.0080 4.2150 -1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 3.1070 -2.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 1.8690 -1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 0.7490 -2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3240 -0.5090 -1.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 -0.6550 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0820 0.4720 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6960 1.7270 -0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -2.0050 -0.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1380 -3.0000 -1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4970 -4.1920 -0.8570 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5430 -4.4550 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -3.5450 1.3520 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 -2.3210 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5090 -1.3080 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -0.5930 1.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9930 0.3500 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 0.5920 3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -0.1140 4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3780 -1.0590 3.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5440 -1.7470 3.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 1.5230 4.8560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 2.2130 4.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 3.1990 5.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0620 3.3140 6.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 4.2180 7.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7550 5.0080 7.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 4.8940 6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9620 3.9840 5.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 3.8680 4.8930 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 -5.7180 0.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 5.1410 -2.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 4.1100 -1.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 4.2380 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 0.8630 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -1.3790 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9120 0.3620 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2250 2.6000 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -2.7980 -2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 -0.7790 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 0.9020 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7080 0.0770 4.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 -2.5680 3.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 1.4950 4.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3020 2.7450 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9490 2.6990 6.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 4.3080 8.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 5.7140 8.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 5.5110 6.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1550 -6.3960 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9650 -5.9260 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 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 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 M END