IFLAB-ZINC04504541 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.6760 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -4.0630 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 -4.6110 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -3.7800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7780 -2.3980 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -1.5840 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -1.1870 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6140 -0.2790 -0.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -4.3140 0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -5.7390 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7680 -6.1500 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -4.9480 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -4.4700 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 -6.2860 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6380 -7.1640 -0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4490 -6.7140 0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -8.5380 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 -9.5340 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 -8.9130 -1.3540 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8360 -9.8140 -2.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4850 -8.5260 -1.1160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 -7.4150 -1.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -2.2490 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -5.6840 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 -0.6470 -1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7100 -2.0720 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 0.0230 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 -0.8190 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 0.6060 -0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -6.1320 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 -6.1420 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -7.2370 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2470 -5.7570 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -5.7470 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 -6.6680 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -8.4550 1.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 -8.8870 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1500 -9.5440 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -10.5330 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -7.6100 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 -6.5740 -1.8880 H 0 0 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 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M END