PUBCHEM-ZINC04461595 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -4.2850 -1.1650 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -2.0230 -1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2670 -2.7240 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -3.5130 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -3.6040 -0.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 -2.9080 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -2.1160 -2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -1.3720 -3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.1570 -3.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -2.0420 -4.8470 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9210 -3.4900 -4.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5990 -3.8220 -4.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5180 -3.8540 -6.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -2.6940 -7.3900 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -1.3700 -6.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2090 -0.6000 -6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.7590 -6.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -1.8690 -5.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.0380 -7.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.2380 -4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -4.1710 -4.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -3.5630 -4.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -5.4550 -5.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8630 -6.1170 -4.9890 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6630 -5.3960 -5.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -6.6760 -3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -7.2430 -5.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 -7.4730 -6.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -8.5060 -7.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -9.3090 -7.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -9.0800 -7.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -8.0490 -6.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -0.1780 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2260 -1.0670 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2330 -1.6290 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1790 -2.6570 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3230 -4.0590 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -4.2210 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -2.9800 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -4.8930 -6.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -3.6420 -6.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -2.7690 -6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -1.5470 -6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -2.0820 -4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 0.7530 -7.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 0.3970 -7.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.7480 -8.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -0.3020 -4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 0.8320 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 0.8970 -4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -5.9410 -5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 -7.1690 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -5.8620 -2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 -7.3970 -3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -6.8450 -6.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2240 -8.6850 -8.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -10.1160 -8.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -9.7070 -7.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -7.8730 -5.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 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 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 55 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 M END