PUBCHEM-ZINC04517237 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -0.9490 2.6810 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5910 1.2120 0.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 0.3420 0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -1.1390 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 -2.0340 -0.1100 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3130 -1.5980 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -3.4680 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -3.9030 -0.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -2.0600 1.1490 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -2.0720 1.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -2.3800 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0850 -2.3450 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6790 -1.9880 1.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -1.6690 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4860 -1.7120 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6950 -1.3300 3.6590 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.5850 -1.8610 3.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 -0.4990 4.4340 O 0 5 0 0 0 0 0 0 0 0 0 0 -9.1410 -1.9390 1.6210 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.8080 -2.1220 0.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6260 -1.7140 2.7390 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0410 3.2850 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 3.0440 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 2.8420 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 1.0900 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.8890 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 0.4780 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 0.6710 -0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -1.2500 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 -1.4590 0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 -2.1080 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -2.6830 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6790 -2.6040 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3450 -1.3850 3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 -4.0350 -1.3540 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 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 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 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 16 1 M CHG 1 18 -1 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 35 -1 M END