IBS-ZINC05025998 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 0.0730 1.4910 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0350 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.4900 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -0.6900 -1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 -1.0380 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -1.1590 -3.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -1.2180 -2.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7970 -1.0870 -1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -1.2620 -1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -0.7730 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8690 -0.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3390 -0.2690 1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9740 -0.6600 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5300 0.5640 1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2930 0.6730 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 -0.4360 3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 -1.6550 3.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1830 -1.7690 1.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -3.0970 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.7020 -2.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -0.3710 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -0.7060 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -0.3600 -3.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 -0.6800 -5.1530 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 -1.8750 -5.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -1.7370 -6.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -0.4920 -7.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 0.1490 -6.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 1.8110 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 1.9290 -0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 1.8200 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -0.4730 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -0.3540 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6340 -1.4480 -3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 1.4300 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7260 1.6240 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1020 -0.3480 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 -2.5190 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -3.6520 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 -3.6680 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -2.9320 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -1.0740 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -0.9490 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 0.6930 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 -0.1280 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -1.7700 -3.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 -0.9380 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6130 0.7040 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -2.7590 -4.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3940 -2.4950 -7.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7310 1.1710 -6.2380 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 2 0 0 0 0 3 20 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 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 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 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 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 28 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 28 51 1 0 0 0 0 M END