PUBCHEM-ZINC05606657 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 1 0 0 0 0 0999 V2000 -1.8760 1.3480 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 0.2330 -1.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -0.8690 -1.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5280 -0.4950 -1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -1.7530 0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3490 -2.0380 0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -3.0490 -0.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3010 -2.8320 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 -3.7540 -1.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 -2.9820 -2.5750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9870 -2.7520 -2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -1.6830 -2.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2560 -1.0960 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -1.9990 -2.4320 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -1.1790 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -3.8740 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -3.9230 0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 -3.7390 2.0070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5950 -2.8660 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1750 -3.5460 3.3250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8690 -3.2630 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -4.7940 3.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -6.0590 3.7570 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9190 -6.0500 4.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 -6.2480 2.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6770 -7.1230 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8440 -4.9940 2.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6130 -4.8370 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5050 -5.1760 0.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1340 -5.9170 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -6.5410 1.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0520 -5.7920 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 2.1470 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 1.0880 -2.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 1.7130 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -3.4280 -4.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3750 -4.1570 -3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -4.9380 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -4.6370 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1800 -5.1590 -3.6800 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7480 -5.8680 -4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -5.0510 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1710 -5.5120 -2.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -7.2470 3.9030 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8540 -8.0990 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -7.1140 4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -7.4420 2.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 -2.4050 3.1720 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.6990 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 -1.8510 4.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -1.7180 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -0.9550 1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7020 -0.5650 1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1840 -0.0920 1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 52 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 27 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 48 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 44 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 M CHG 1 40 1 M CHG 1 44 1 M CHG 1 48 1 M END