IFLAB-ZINC04162890 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -2.4250 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1640 -3.7560 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -3.8650 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -2.5780 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -1.7170 0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -0.2570 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5390 -2.2060 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3540 -5.1140 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 -5.6350 1.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7230 -5.6790 -1.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -6.9210 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7840 -7.3460 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -8.6230 -2.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0980 -9.8690 -2.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1230 -10.7750 -2.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.0180 -11.7380 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3240 -10.1160 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0390 -8.7390 -2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0780 -7.8180 -2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3690 -8.2590 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6550 -9.6160 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6460 -10.5420 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 -4.8960 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2040 0.1160 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 0.0300 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2990 0.1700 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8810 -2.1210 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -1.2510 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1150 -2.9760 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 -5.2640 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9340 -7.7040 -0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4430 -6.7590 -0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3500 -6.5620 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8420 -7.5070 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0520 -10.1210 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8630 -6.7600 -2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1720 -7.5450 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6800 -9.9490 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8780 -11.5960 -2.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -5.1760 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -5.7500 -0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -4.5850 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END