PUBCHEM-ZINC01622304 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.2230 1.4430 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.0430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.8660 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 -2.2130 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -3.4720 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -4.6290 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -4.5540 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -3.3260 -1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -2.1680 -0.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.8510 -1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -0.3890 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -0.3950 2.5570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4180 0.6480 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -0.5010 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -1.4510 4.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 -1.9400 5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4420 -2.8120 6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -3.1750 6.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.6730 5.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -1.8120 4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -1.1870 3.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -1.3010 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -2.0450 3.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -0.4330 2.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0940 -0.8010 1.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 0.0820 0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 1.1700 0.0820 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2650 1.7370 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.8340 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1330 1.9290 0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 -3.5600 2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -5.5910 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 -5.4600 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 -3.2800 -2.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 0.4660 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.1830 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -0.1060 -2.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 0.4730 3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -0.8770 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -1.6520 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1320 -3.2100 7.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -3.8540 7.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -2.9700 5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 0.5160 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5890 -1.7470 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 -0.4020 -0.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 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 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 2 0 0 0 0 M CHG 1 27 -1 M END