IBS-ZINC05065870 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.6080 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 0.1580 -2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -0.4640 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8390 -1.8650 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.6250 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.0010 -1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.7490 -0.1300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -4.1690 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -2.2160 -4.3800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -3.1260 -4.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -1.0810 -5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 0.0440 -4.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 1.2600 -4.8290 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 1.4090 -5.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 0.3790 -6.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5580 -0.8700 -6.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -1.9430 -7.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -1.4810 -8.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2200 -2.6900 -9.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1080 -3.5910 -9.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 -4.0530 -8.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -2.8440 -7.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5520 -4.6730 -10.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -5.5380 -9.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -6.6060 -10.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -6.8150 -11.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4750 -5.9570 -12.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0290 -4.8890 -11.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -4.0540 -11.8900 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1220 1.2360 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -3.7030 -2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -4.6440 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -4.4850 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -4.4610 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 2.4070 -6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 -0.9360 -8.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -0.8260 -7.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 -2.3520 -9.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -3.2200 -8.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -4.7080 -8.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -4.5980 -7.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -3.1820 -6.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -2.3140 -7.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -5.3750 -8.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -7.2780 -9.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7750 -7.6510 -12.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -6.1230 -13.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 M END