PUBCHEM-ZINC05551884 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.7570 -0.0090 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -0.4740 1.5800 S 0 3 0 0 0 0 0 0 0 0 0 0 -0.3880 1.1980 2.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.5880 0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -1.9780 0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3460 -2.0330 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3850 -2.4460 -0.1080 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3870 -3.0370 -1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7710 -3.3380 1.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3890 -4.1680 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3770 -3.9210 1.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1550 -4.7310 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -2.8980 1.1470 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 -4.4420 2.7590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -3.7110 3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 -4.4700 4.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 -5.7570 4.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -5.7620 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -6.8380 2.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9170 -7.9750 2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -8.1210 4.3150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -7.0040 5.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 -7.1380 6.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2700 -2.5380 2.0310 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.3090 -1.3740 -0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7210 -1.4030 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 0.3280 0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.8770 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 0.7940 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7710 1.8960 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 1.1730 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 1.5600 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -0.4300 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 0.1890 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -2.6340 3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -8.8970 2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -6.3110 7.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 -8.0660 6.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 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 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 2 1 M CHG 1 24 -1 M END