PUBCHEM-ZINC02779029 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 31 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.7000 -1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -2.4980 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -2.4320 -0.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4090 -3.3480 -2.3670 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -4.2160 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3460 -5.0630 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7340 -6.2990 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -7.0790 -4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9350 -6.6200 -6.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 -5.3720 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7580 -4.6040 -5.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7150 -7.4500 -7.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -8.5350 -7.1610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3390 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -1.7370 -1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -3.3860 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7050 -4.8620 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -3.6040 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -6.6520 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -8.0430 -4.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -5.0110 -7.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2390 -3.6410 -5.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1110 -7.0040 -8.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 -7.5830 -9.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 30 31 1 0 0 0 0 M END