IBS-ZINC02453187 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 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 1.2020 -0.6860 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0130 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3850 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.1700 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7130 1.5770 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 3.5180 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 4.2080 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 3.6140 -0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 5.6820 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 6.3680 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 7.7460 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 8.4550 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 7.7900 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9720 6.4040 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 5.7490 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5800 -0.6560 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -1.7660 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 3.9910 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 5.8190 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 8.2750 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7120 9.5350 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8640 8.3510 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 5.5630 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9140 -0.8460 -0.9210 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 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 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 23 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 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 M END