IFLAB-ZINC04251167 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.6730 0.7160 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 -0.7320 0.0640 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -1.8550 0.9070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.3700 -0.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.1480 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -2.0310 -1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.3600 -2.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -1.8010 -3.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -0.9110 -3.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -0.5940 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 -2.1480 -5.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5330 -2.9230 -5.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -1.6070 -6.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9120 -1.8470 -7.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -1.9360 -8.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -2.1730 -9.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -2.3250 -9.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0090 -2.2350 -8.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 -1.9930 -7.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 -2.5800 -10.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -2.7450 -11.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0880 -2.7150 -10.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7850 -2.9610 -12.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9730 -3.1900 -13.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9540 -3.3730 -14.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -3.3300 -15.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5760 -3.1070 -14.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 -2.9180 -13.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5880 -2.6890 -12.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 0.4530 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 1.5220 -0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 1.0460 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -2.4630 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1520 -3.0490 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.4750 -4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 0.0910 -2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -1.0490 -6.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -1.8180 -8.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -2.2420 -10.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -2.3520 -8.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8070 -1.9200 -6.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9090 -3.2230 -12.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8780 -3.5500 -14.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 -3.4760 -16.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -3.0760 -14.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 29 2 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 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 28 29 1 0 0 0 0 M END