IFLAB-ZINC04347031 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -0.5960 -0.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.7560 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -2.1560 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -2.8530 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6370 -2.1710 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -0.7810 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -0.0740 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -2.8660 0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -2.1040 0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0120 -1.4060 -0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -3.0470 -0.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.1880 -3.7710 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 -2.2290 0.0060 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5500 -1.5400 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5150 -1.4370 1.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.5180 -2.1280 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2650 -0.5560 1.3830 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2820 0.1620 0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 -1.3750 1.2740 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2390 0.1940 2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 1.1030 2.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6830 -0.6160 1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6290 -3.1090 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1530 -3.7530 -1.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.4210 -4.8780 -1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8100 -5.3070 -0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -5.6040 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -2.6860 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -3.9330 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 -0.2560 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5010 1.0050 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1690 0.7490 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1310 -0.5200 3.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 1.6140 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7560 -0.0850 2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4830 -2.6570 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6410 -3.4100 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 -4.9410 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7260 -6.4840 -2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3660 -5.9110 -3.0830 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 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 M END