PUBCHEM-ZINC06858590 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.5160 1.5000 -0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 0.0050 -0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1250 -0.6550 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.0480 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -2.7850 -0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5460 -2.1450 -1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 -0.7520 -1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -4.5590 -0.3560 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -5.0800 -1.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -4.9090 0.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3420 -4.7350 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -5.1960 -1.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5740 -5.0070 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -4.3700 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -3.9370 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -4.1000 -2.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 -5.8630 0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0740 -5.9310 1.1170 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5480 1.7990 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 1.8910 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1450 1.9630 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.0860 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -2.5480 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -2.7180 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -0.2590 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -5.3560 -1.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -4.2140 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -3.4300 -4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -6.2960 0.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -4.9100 -0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -5.3740 0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 26 1 0 0 0 0 14 15 2 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 17 18 1 0 0 0 0 17 29 2 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 18 -1 M END