PUBCHEM-ZINC00559623 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 32 0 0 0 0 0 0 0 0999 V2000 2.2080 1.4820 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 0.1310 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 -0.7070 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -0.1500 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 1.1940 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 2.0140 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 1.7780 -1.9580 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.0180 1.0030 -2.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 3.0730 -2.1950 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2710 -2.0940 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -2.8290 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 -2.3210 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1130 -3.4770 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -4.6000 0.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -4.3010 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -5.1000 0.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -3.4240 0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 -4.5330 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 -4.1990 0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -2.8520 0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4690 -1.9580 0.2740 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 2.1300 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1050 -0.2840 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 -0.7840 -1.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 3.0750 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -2.5930 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -1.2820 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -5.5520 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4370 -4.9360 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9040 -2.4190 0.4280 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 10 1 0 0 0 0 4 5 2 0 0 0 0 4 24 1 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 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 30 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END