PUBCHEM-ZINC05721755 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -1.2890 -2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 -1.7350 -3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -1.3810 -3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -0.5820 -2.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0220 -0.1320 -1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -1.8600 -4.7300 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1050 -2.5640 -5.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -1.5480 -4.9320 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -2.6340 2.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.0380 2.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 0.0930 3.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -0.1800 3.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 0.5790 4.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -1.5650 -1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -2.3600 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6990 -0.3060 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 0.4960 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8880 0.1800 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -0.1060 5.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 0.6210 5.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 1.5740 4.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 -2.6760 0.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -3.6420 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 24 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 9 27 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 17 28 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 20 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END