PUBCHEM-ZINC06856980 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 46 0 0 1 0 0 0 0 0999 V2000 -0.2300 1.6030 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 0.1360 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.2740 -0.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.6580 0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -2.1250 -0.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1080 -2.3770 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -2.7230 -1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -2.2110 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4960 -3.1250 -4.0370 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -2.2740 -5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 -2.7050 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -2.0120 1.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 -4.0350 1.5790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.6350 2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -5.1840 3.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -5.5220 1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -4.9400 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8090 -6.8180 4.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -8.2210 3.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -8.7280 3.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -9.6610 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 2.1620 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 1.9540 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 1.7820 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -0.2020 0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.5130 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -3.8150 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -2.3590 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -1.1460 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -1.2090 -5.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 -2.7040 -6.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5250 -2.3970 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -5.4470 2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -3.9210 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -5.7320 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -4.3860 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -4.7360 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2330 -6.2950 1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 -4.4420 0.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 -5.7460 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -6.1980 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -6.8990 5.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -8.8790 4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 -8.1960 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -6.1520 3.1090 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3420 -6.9710 2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 16 45 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END