IFLAB-ZINC04315056 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0440 1.7420 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 0.2660 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 -0.1720 1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -1.5230 1.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -2.4540 0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -2.0370 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -0.6820 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -0.2260 -2.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -0.9910 -3.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -2.2080 -3.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -0.1720 -4.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -0.5840 -7.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -1.6150 -8.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -1.9780 -8.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6760 -2.4680 -7.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5070 -1.4300 -6.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -2.9590 -9.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 -4.2500 -9.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -4.6860 -8.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -4.8550 -10.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9050 -6.1390 -11.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 -6.4140 -12.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 -5.4460 -13.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -4.1650 -12.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 -3.8730 -11.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -2.7110 -10.7190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 1.9340 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 2.1250 -0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 2.3100 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 0.5420 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -1.8470 2.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 -3.5100 0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -2.8070 -1.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 0.7750 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 0.3270 -4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 0.5650 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.3680 -7.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6490 -0.4130 -6.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -2.5110 -8.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -1.2150 -9.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -1.0600 -8.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -3.4110 -6.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7430 -2.6770 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -1.8210 -5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0350 -0.4990 -6.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -6.8930 -10.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -7.4020 -12.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -5.6880 -14.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -3.4110 -13.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -1.0950 -5.8970 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4340 -1.9760 -5.6230 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 50 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 17 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 26 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 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 25 26 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END