PUBCHEM-ZINC05657258 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.3210 1.3800 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.1290 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 -0.5300 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -0.9920 1.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -1.3600 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -1.2660 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7220 -0.8050 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3990 -0.4290 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 0.0430 -2.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.9980 -3.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3360 -0.7040 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -1.8560 2.0080 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.2250 -1.9390 3.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 -2.1800 1.8330 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7180 1.6700 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 1.9070 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 1.6390 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.3880 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.6560 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -1.0670 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5040 -1.5540 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 0.8600 -2.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -0.6320 -4.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -1.7750 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 0.3040 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -0.9200 -3.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 -1.4220 -2.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END