IBS-ZINC02105908 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 0.2760 0.8720 -0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -0.6470 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 -0.9800 -0.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -1.2060 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 -1.1880 -2.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4840 -1.4880 -0.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2100 -0.7450 -0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -2.9080 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9120 -3.4200 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8520 -4.5130 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1200 -5.3750 -1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -6.3180 -1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7960 -6.4190 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5510 -5.5790 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5610 -4.6120 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 -3.6440 1.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3790 -3.4820 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -2.9360 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3120 -1.7690 1.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9680 -0.9080 1.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -1.4340 0.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -1.1040 0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -0.8600 2.5450 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -2.1550 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -3.1660 3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -3.5240 4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -2.8680 5.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -1.8500 5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0680 -1.4930 4.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8760 -1.2040 6.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -0.1690 6.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0010 -3.2190 6.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -4.2730 6.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.1200 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 1.2460 -1.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 1.3320 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -1.1070 -1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -1.0210 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3720 -2.8930 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 -3.5620 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5820 -5.3030 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3340 -7.0010 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5560 -7.1800 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1010 -5.6680 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4630 -3.6780 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4510 -4.3150 4.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -0.7000 4.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7720 -0.5870 6.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0570 0.2630 7.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4760 0.6060 5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4990 -5.1810 6.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -3.9890 6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 -4.4520 7.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 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 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 31 48 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 M END