IBS-ZINC05552611 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 0 0 0 0 0 0999 V2000 0.1650 1.6020 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.2100 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -0.5780 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 0.0180 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 1.4060 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 2.2040 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 1.9550 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 -2.0440 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -2.6540 -0.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.0020 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -4.7770 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -6.1740 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -6.9750 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -6.4010 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 -5.0030 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -4.2050 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6740 -7.2660 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -8.5240 0.1440 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7330 2.2150 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -0.2510 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3790 -0.5780 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 3.2880 -0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 2.9230 -0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0730 -2.6020 -0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9440 -4.4970 -0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -6.6580 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -8.0580 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5180 -4.5300 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5030 -3.1240 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7990 -6.6740 0.1360 O 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 1 0 0 0 0 17 30 2 0 0 0 0 M CHG 1 18 -1 M END