PUBCHEM-ZINC03652356 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 -0.1770 1.6480 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -0.1470 0.1530 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 -0.5270 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -2.0330 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5630 -2.3820 -0.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9980 -1.8750 -0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6260 -3.9330 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -4.5800 0.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -2.0160 1.1380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -2.8340 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7110 -1.9800 0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 -1.5170 2.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 2.0710 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 2.0830 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 1.9080 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -0.1540 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 0.0010 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -2.4010 -0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -2.5570 0.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9760 -1.2720 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -2.9610 0.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 -1.0840 2.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5900 -4.3420 -1.4840 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 3 17 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 M CHG 1 23 -1 M END