IFLAB-ZINC02710719 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.5150 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0150 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5130 -0.3770 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.5180 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -0.7060 1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.7650 2.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -0.6510 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5300 -0.9490 3.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -0.1710 1.7130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3150 0.9130 1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -0.6410 0.0310 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.5660 -0.8240 2.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -1.2260 3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4910 -0.0380 4.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 1.0830 3.9180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -0.2220 5.2950 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 0.8830 5.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 2.0520 6.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6760 3.1410 6.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 3.0670 7.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6930 1.9050 7.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 0.8100 6.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 1.8860 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 1.8750 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.8740 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 -0.5560 3.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -0.4750 1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -1.9080 1.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -1.8770 4.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -1.7780 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -1.1200 5.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 2.1100 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 4.0510 6.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 3.9200 7.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6930 1.8510 7.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -0.0990 6.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 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 13 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 M END