IFLAB-ZINC04305779 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 -8.1310 -2.4640 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 -3.9840 1.1400 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.3380 -4.6020 1.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2820 -3.1440 2.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.2450 -3.8020 3.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -2.1970 2.4430 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1580 -2.7800 2.4620 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 -6.1510 -1.3130 3.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -0.5110 3.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4920 -2.3840 2.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3930 -4.8210 1.0730 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0920 -3.8370 -1.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 -3.3340 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0340 -2.2280 -2.5050 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4140 -4.1460 -3.7330 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 -7.0260 -0.6660 3.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 -1.9410 4.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 0.0760 4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5880 -1.8270 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4730 -5.4410 1.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6950 -4.7210 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9670 -5.0790 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8240 -3.5800 -4.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3640 -4.3670 -3.9230 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