PUBCHEM-ZINC06505056 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 -0.0260 1.4610 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.0040 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.6500 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 -0.0370 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -2.1290 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 -2.7780 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 -2.0110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -0.6930 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 0.1960 0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8310 -1.1630 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2710 -4.1410 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.8340 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 -2.2730 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 1.8410 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.8230 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5380 1.8080 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8420 -0.7570 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6960 -1.7680 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -1.7820 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -4.6920 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -4.5570 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 M END