CHEMBRIDGE-ZINC00316441 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.1990 -0.6920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 2.1290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 3.3440 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 1.3980 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.0560 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2490 -0.8020 -0.0610 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6420 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -1.6120 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 2.0830 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 2.3140 1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8950 3.0190 1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1830 4.1750 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4960 4.4540 1.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9960 5.2240 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9640 3.4590 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0030 2.6020 0.7560 N 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 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -1.7720 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 1.4690 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 3.0420 -0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 2.9280 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6620 1.3550 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5080 4.7670 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9700 3.3830 0.5760 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 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 14 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 14 15 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 M END