PUBCHEM-ZINC04187352 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 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 0.0230 -0.7010 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0840 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0760 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 0.0730 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -3.6110 -2.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -4.2120 -3.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -4.9000 -4.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -4.1640 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 -3.5650 -2.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -6.4630 -4.7620 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 -6.6380 -5.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -6.6850 -5.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -7.5110 -3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -7.9000 -2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -8.7220 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -9.1560 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -8.7690 -1.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 -7.9500 -2.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -9.2330 -1.0640 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3390 -9.9570 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 -8.8910 -1.5440 O 0 5 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 0.0250 -0.1640 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6250 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.8530 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 0.2700 -2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -0.5190 -3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 1.0180 -2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -4.4140 -1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1040 -3.0050 -2.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -3.4160 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -4.9250 -4.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -3.3640 -4.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 -4.8450 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -2.9250 -2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -4.3680 -1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -7.5600 -3.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -9.0250 -1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -9.7980 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0640 -7.6490 -3.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.7710 -2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 47 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END