PUBCHEM-ZINC00985169 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -2.3620 -2.4410 -3.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -2.5740 -2.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -2.0560 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -1.4350 -1.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -0.9050 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -1.0010 1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -1.6230 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -2.1560 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -2.7720 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -1.9520 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -1.7170 2.3750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -1.2630 3.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 -0.2380 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2770 -0.6820 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2840 0.2050 -0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7880 1.1720 0.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 1.9370 0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 0.8750 0.6850 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.5320 0.0600 -0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7010 -0.8380 -1.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7830 -1.7730 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4650 -1.9040 -1.4830 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.6540 -1.9700 -2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 -3.1390 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6850 -4.2140 -0.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 -5.1280 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0190 -4.5570 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -3.3490 0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0730 -2.6730 -3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3030 -3.3870 -4.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.8730 -0.8010 -2.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8470 -2.8950 -4.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3170 -2.9420 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -1.3840 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8620 -1.3610 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4690 -0.5910 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9290 -2.5660 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -1.4910 -1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -1.1750 0.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -1.4230 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9790 -0.2000 3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -1.8190 3.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9280 -4.3530 -1.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -6.1000 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5130 -4.9930 1.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5510 -0.1420 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0230 -1.4340 -3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 29 30 3 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 M END