PUBCHEM-ZINC06524263 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 31 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3510 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 1.2460 -0.6700 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 0.0370 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 1.3680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 1.9950 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0340 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.4980 0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6510 3.8830 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 4.0320 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 5.2770 1.6680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5920 5.1490 2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 5.3490 0.5880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2320 6.0190 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 3.9960 0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 5.8170 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3620 5.9880 0.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 6.4800 1.6340 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 6.6020 2.3690 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5510 6.7230 3.1040 N 0 5 0 0 0 0 0 0 0 0 0 0 1.2950 -2.0460 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.7060 0.0100 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 1.8840 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 3.2880 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8910 4.3120 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7420 5.0710 1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 6.7660 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2260 6.2840 0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -2.5600 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 -2.5010 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 7 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 4 2 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 19 20 2 0 0 0 0 21 29 1 0 0 0 0 21 30 1 0 0 0 0 M CHG 1 19 1 M CHG 1 20 -1 M END