IBS-ZINC02272427 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8640 -2.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -2.7450 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7960 -3.2630 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0910 -3.3720 -0.7380 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -2.7100 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 -2.4930 -2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -2.8100 -3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -3.2850 -3.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3800 -2.5740 -4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -3.0070 -7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9430 -3.5110 -8.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1050 -2.6860 -8.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6560 -2.6550 -6.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5950 -2.1430 -5.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 -3.6870 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -3.7730 3.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -2.6090 3.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -2.5350 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -2.6900 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 -1.3600 3.4410 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 -2.2260 -2.1130 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 -1.5130 -5.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -3.1490 -5.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -3.6660 -7.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5690 -1.9960 -7.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5680 -3.4650 -9.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 -4.5410 -7.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5190 -1.9910 -6.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9620 -3.6600 -6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3270 -1.1180 -6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9920 -2.1710 -4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 -2.9480 2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 -4.6590 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -3.3140 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5880 -1.5560 2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -3.5790 5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1500 -1.8030 5.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5890 -2.7450 5.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9690 -1.4150 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -0.4740 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -1.3030 2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 -2.9980 -5.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 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 10 2 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 20 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 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 52 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 M END