PUBCHEM-ZINC06145233 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 54 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.6300 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 0.0140 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.1360 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7050 -2.5890 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -4.1180 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 -4.5650 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 -3.7420 0.0310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -5.8800 0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -6.8740 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -7.2280 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -8.1710 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4440 -8.5240 2.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -9.2130 3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -8.2710 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 -7.9170 2.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9000 -6.3140 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3930 -6.4550 -1.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6500 -6.2170 -2.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6610 -6.8470 -1.6290 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1160 -6.9770 -2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3120 -7.3460 -3.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.5750 -7.4170 -4.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5520 -7.0920 -5.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1820 -6.6680 -4.3340 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7530 -2.5140 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.5230 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -2.2110 0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2130 -2.2020 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -4.4960 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.5060 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7680 -7.7710 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 -6.4640 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -6.3180 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 -9.0810 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -7.6800 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -9.1960 2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -7.6140 3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8790 -10.1240 3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -9.4660 4.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6660 -8.7620 4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -7.3600 4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -7.2450 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 -8.8270 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 -7.2740 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 -5.5740 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2560 -7.0380 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5400 -7.7130 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5630 -7.0870 -6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 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 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 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 17 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 M END