PUBCHEM-ZINC05912479 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -0.3690 1.8220 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.3420 -0.0210 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1030 -0.0950 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.1640 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -0.9920 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.5820 1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9670 -0.2360 1.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2350 -0.6110 0.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8660 -1.6400 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3030 -0.4130 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 -0.5940 -2.3050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1910 -1.6060 -2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 0.4290 -2.5020 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9070 1.4580 -2.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 0.2270 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 0.2200 -3.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -0.1440 -4.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -0.2770 -5.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -0.3740 -3.5730 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0270 0.5400 -3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -1.5790 -3.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -2.1860 -5.8040 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7750 -3.6510 -5.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0660 -2.0210 -7.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0970 -2.7940 -7.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9400 -2.3440 -7.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3250 -1.6020 -5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1240 -0.2800 -5.0280 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5030 2.4720 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 2.1860 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7270 1.9830 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -1.0890 0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 0.5850 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 -0.5970 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 0.8490 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4380 -2.0520 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -0.9000 3.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2470 -0.2400 3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7370 0.0650 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1030 -1.1550 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 0.5770 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 0.9560 -1.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -0.7560 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 -2.4620 -4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0180 -1.8020 -3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8250 -4.0060 -5.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 -3.8080 -4.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5710 -4.2930 -5.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -0.9760 -7.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -2.3550 -7.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -1.9840 -5.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4400 -2.1530 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9210 -1.2800 -5.2800 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5790 -0.4510 -5.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -0.9770 -6.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 15 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 22 53 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 53 54 1 0 0 0 0 53 55 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 53 1 M END