IBS-ZINC05206891 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 1.9410 1.1990 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -0.1410 2.4730 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4710 -0.3360 1.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -1.2400 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -2.3630 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -2.6780 2.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1810 -3.1830 2.5260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7760 -3.4290 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -4.4380 3.3810 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0910 -4.2150 4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -3.2800 4.3540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -5.1560 5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 -4.7760 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -4.2990 5.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 -5.6090 3.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -5.9600 4.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -5.1640 5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9600 -5.5230 5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6240 -6.6710 5.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -7.4140 4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -7.0440 3.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -2.1220 3.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -1.5130 2.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -0.5400 3.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -0.1730 4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -0.7850 5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -1.7620 4.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7980 0.7850 5.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -1.4800 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -1.6170 0.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3230 -0.0990 1.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 1.1650 3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 1.9950 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 1.3910 3.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -5.2690 2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -1.1050 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.4680 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -5.9650 5.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 -4.6140 6.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -5.5700 5.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -5.9650 2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2530 -4.2780 5.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3460 -4.9250 6.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5360 -6.9790 5.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6170 -8.3070 4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -1.7990 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5500 -0.0640 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 -0.5010 6.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -2.2420 4.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 0.4420 6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 0.1610 2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 0.6330 0.9530 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 2 4 1 0 0 0 0 2 31 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 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 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 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 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 28 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 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 M END