IBS-ZINC02249682 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0060 1.5630 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 0.1780 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 -0.6230 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -0.0360 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 1.3510 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 2.1540 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 2.0020 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 1.2970 -0.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 2.1020 -0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 1.4410 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2230 2.0890 -0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3750 1.3520 -0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4900 1.8610 -0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1010 -0.1400 -0.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5230 -0.5350 0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2760 -0.2790 -0.0690 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6630 -0.8100 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6170 -2.3310 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8510 -2.8260 -0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3410 -0.8760 0.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 2.1820 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -0.2780 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9080 -1.7010 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 3.2340 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 3.1010 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2600 3.0960 -0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1510 -0.4580 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7190 -0.5390 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 -0.3260 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 -2.9100 -2.4060 O 0 5 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 M CHG 1 30 -1 M END