IBS-ZINC00089002 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 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 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0590 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -0.0370 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 0.3350 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 0.6030 -3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1500 0.9560 -4.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 1.0530 -4.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2430 0.7990 -3.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5610 0.4320 -2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 0.1710 -1.2910 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 -0.1710 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2080 -0.2800 -0.1870 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2900 -0.4510 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6120 -0.8150 2.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 -1.0740 3.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7000 -0.9740 3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3820 -0.6140 2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6840 -0.3460 1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3530 0.0130 -0.0740 O 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 -0.8760 -2.4820 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -2.3460 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 -2.4360 0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 0.0280 -2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 0.5310 -3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 1.1640 -5.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 1.3350 -5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3200 0.8780 -3.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -0.8940 2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7940 -1.3560 4.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2470 -1.1780 4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4590 -0.5390 2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6130 -0.7330 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 M END