PUBCHEM-ZINC05162168 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 23 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3620 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 1.2520 -0.6510 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3470 -2.0530 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -2.6550 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7390 -1.9040 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 -0.5170 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 0.1340 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 1.4640 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 2.0730 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 0.2710 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 1.4850 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -4.1330 -0.0460 N 0 3 0 0 0 0 0 0 0 0 0 0 1.6360 -4.8010 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 -4.6800 -0.0600 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8900 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -0.5720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -2.6540 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -2.4050 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 3.1520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -0.3550 -0.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9170 0.2050 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 16 1 0 0 0 0 2 3 2 0 0 0 0 2 17 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 18 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 19 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END