PUBCHEM-ZINC05933042 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2150 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 0.0350 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 1.4160 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.5660 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0820 4.1580 0.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 4.1920 0.0040 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7010 -0.6820 -0.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7440 -0.0540 -0.0430 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -1.9000 -0.0430 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2370 -2.0800 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.7320 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -4.0500 -1.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -4.7580 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -5.9680 -0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -4.0620 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 -2.7440 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9720 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 -2.1880 -2.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -4.5700 -2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -6.4170 0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -4.5920 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -2.2090 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 25 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 27 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END