PUBCHEM-ZINC06761319 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 21 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 1.0560 -0.5940 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -2.5540 -0.0030 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5900 -3.3010 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -4.8250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8510 -5.1330 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8300 -5.4440 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 -5.8720 0.8710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8590 -0.5240 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -0.5150 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1240 -2.9870 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1410 -2.9770 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -4.9210 1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4340 -5.5220 -1.3110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -5.2710 1.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3710 -4.9970 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -5.9270 -1.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 14 1 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 2 0 0 0 0 9 19 1 0 0 0 0 18 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 M END