PUBCHEM-ZINC05594503 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2180 -0.6610 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0150 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.3340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0590 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 2.0580 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4610 3.4690 -0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5570 4.2730 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5540 5.7360 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 6.7050 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8830 8.0280 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2170 8.4200 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 7.4910 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9050 6.1330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6550 4.9870 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6240 4.9490 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 3.8790 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 9.0560 0.0240 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6470 8.7190 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 10.2380 0.0280 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9230 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.7410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 3.1380 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2650 1.7780 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2490 1.7870 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 6.4090 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4640 9.4710 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2500 7.8080 -0.0250 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END