IBS-ZINC02097309 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3810 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 1.1820 -0.7280 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 0.0030 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 1.4180 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1370 2.1260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7330 1.8560 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 0.7400 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -0.3740 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9960 -1.2910 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9900 0.7120 -0.1910 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3190 0.8740 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 -0.6540 0.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 5.8350 -1.4930 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -0.8200 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8200 -1.5300 0.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5970 -1.6930 2.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 -1.2210 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5090 -0.2990 1.8750 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4790 -0.3550 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8950 1.1490 1.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4340 1.7120 2.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 1.7290 0.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 3.1320 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5360 3.4910 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1800 3.2990 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 1.8910 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.5380 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.8080 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 3.2060 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8600 -1.3820 -1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3210 0.1680 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7350 -1.9390 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3460 -2.1970 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7430 -2.0880 2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6310 -0.7060 3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5720 3.7580 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6230 3.3000 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6440 4.5310 -0.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6010 2.8440 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 3.9280 -0.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 3.5950 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END