IBS-ZINC05345540 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 0 0 0 0 0 0999 V2000 2.4960 -1.3920 -1.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.2660 -0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.6090 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 -2.1280 1.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -2.3610 3.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5930 -2.0840 3.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -1.5750 2.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 -1.3310 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0660 -0.8380 -0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 -0.5600 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -0.7980 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3270 -2.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.8600 -2.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.2100 -3.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 -0.7510 -4.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 -1.4990 -5.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9530 -3.3330 -4.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.6570 -3.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -3.7020 -6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -5.1620 -6.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -6.0000 -5.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 -7.3400 -5.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -7.8460 -6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 -7.0010 -7.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -5.6600 -7.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -7.7300 -7.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -9.1060 -7.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -9.1040 -6.4690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -2.8640 4.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 -3.0820 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -2.3770 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.6240 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 -1.2670 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4880 -2.3440 1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1040 -2.2720 4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -1.3640 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 0.3210 -4.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.9660 -5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -1.2030 -5.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -1.2530 -6.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8690 -4.4160 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -3.0160 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -3.0510 -3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -2.8450 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -3.3280 -7.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6450 -3.5810 -6.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -5.6080 -4.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -7.9930 -4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -5.0040 -7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -9.4290 -8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -9.7450 -7.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -2.1380 5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.7910 5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -3.4850 6.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -2.9450 -5.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 11 2 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 35 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 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 55 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 17 55 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 29 30 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 M END