PUBCHEM-ZINC00417904 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.0090 1.4110 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -0.0880 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.7800 0.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -2.1780 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -2.8360 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 -2.1550 0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 -0.7870 0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4440 -0.3760 0.4410 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -1.4390 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4530 -2.5680 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -3.8810 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -4.7970 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -6.0880 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -7.2450 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -6.6160 0.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -5.2840 1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7160 -1.4010 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3440 -2.2950 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 -2.2590 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4710 -1.3350 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -0.4400 0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 -0.4760 0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5940 0.4660 1.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8220 -1.3030 -0.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 1.7640 1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 1.8680 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 1.6850 1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1140 -0.2570 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1060 -2.7280 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -3.9100 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -3.9480 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -4.3110 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -6.2350 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -6.0300 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -7.9540 0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 -7.7480 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -7.2650 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -6.4260 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -4.5710 1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -5.4570 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -3.0160 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1990 -2.9520 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 0.2150 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 0.1500 2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3020 -1.8720 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 M END