IBS-ZINC02249682 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2040 -0.6880 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4130 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 2.1650 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 1.5270 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 2.1870 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 1.5440 -0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2920 2.1100 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3720 1.3490 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4970 1.8020 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0850 -0.1350 -0.0820 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4980 -0.6090 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 -0.2160 -0.0580 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6450 -0.7870 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4540 -2.2800 -1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9240 -2.7720 -0.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -0.6610 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.7680 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 3.2450 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 3.0760 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 -0.3990 -2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7080 -0.5610 -1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9150 -0.8510 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8720 -3.0640 -2.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7280 -4.0150 -2.1810 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 21 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 30 1 0 0 0 0 20 29 1 0 0 0 0 30 31 1 0 0 0 0 M END