PUBCHEM-ZINC06761104 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 1 0 0 0 0 0999 V2000 -0.4510 0.3810 -0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 0.1070 0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 0.2240 2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 -0.2130 3.2690 O 0 5 0 0 0 0 0 0 0 0 0 0 1.3950 -0.3750 1.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4500 0.2440 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 1.5780 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 2.2000 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7270 1.4820 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -0.0280 -0.9780 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5970 -0.4280 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 -0.7020 -0.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9140 -1.2420 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 -1.7030 -0.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -0.3290 -2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 -0.9040 -2.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 0.2530 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4770 0.7240 -0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 2.2290 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8500 3.2800 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5870 1.9890 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -1.4700 -1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 0.7500 2.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8400 -0.0090 -3.0680 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 1 0 0 0 0 2 5 1 0 0 0 0 3 4 1 0 0 0 0 3 23 2 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 22 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 M CHG 1 4 -1 M CHG 1 24 -1 M END