PUBCHEM-ZINC04128010 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.5320 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 0.0020 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -0.4800 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.8060 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -1.2480 -3.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -1.3660 -3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7490 -1.0420 -2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -0.5920 -1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8340 -0.2570 -0.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 -0.9480 0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -1.8060 -0.5600 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 -0.6550 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -1.5970 -4.7280 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.4940 -4.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 -1.9860 -5.7300 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0080 1.9060 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.8980 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.8800 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.3650 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -0.3730 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -0.7150 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -1.7120 -4.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -1.1350 -2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 0.4730 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -1.2860 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 -0.8600 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 0.3940 1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 19 1 0 0 0 0 2 20 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 21 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END