IFLAB-ZINC05256385 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 -0.8150 2.0020 -2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 1.0360 -1.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 0.2450 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 0.3960 -2.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -0.4070 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -1.3630 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -1.5180 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -0.7170 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -2.4580 0.9570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -2.5620 1.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1870 -2.2380 -0.5370 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8750 -3.1690 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8940 -2.5340 -1.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3520 -2.9830 -2.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3990 -3.1160 -3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5410 -2.7390 -3.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 -2.3750 -2.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1740 -1.8850 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -2.0330 0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1500 -1.5310 0.3270 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -0.4580 1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 0.0230 0.8980 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 0.0830 1.9450 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 1.2610 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 1.6120 2.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6040 2.7740 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5910 3.5880 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9220 3.2440 3.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 2.0840 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5820 1.7460 3.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.5460 2.6380 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 2.5650 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 1.4930 -3.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 2.6840 -2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9630 1.1430 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 -0.2880 -2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.8390 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7660 -2.8050 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -1.6130 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6920 -3.3480 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3080 -3.2010 -3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3040 -3.4580 -4.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5240 -2.7280 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3990 -0.8350 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 -2.4680 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1040 -1.4580 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -3.0840 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4810 -0.3430 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 0.9780 2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 3.0470 3.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 4.4950 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6900 3.8820 4.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5490 2.2520 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3790 2.7210 4.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4450 3.6210 3.1090 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 36 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 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 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 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END