IBS-ZINC05490038 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.2590 1.6570 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 0.1370 -0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9240 -0.1230 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 -0.3790 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3290 -2.4600 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 -1.9440 -1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -0.4800 -1.2610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 0.0230 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 0.7240 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.2200 -4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 1.0180 -4.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 0.3190 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -0.1840 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 1.5080 -5.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 1.2630 -5.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -2.3710 2.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6600 -2.0990 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -1.7790 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -3.8720 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -4.4240 1.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -4.6390 3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -4.1640 4.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9660 -5.1940 4.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 -5.1060 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -6.3930 4.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 -6.1070 3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -7.1390 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -8.4430 3.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8800 -8.7280 4.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -7.7160 4.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 1.9120 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 2.0360 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 2.1070 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 -0.0950 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 0.0550 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -3.5430 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 -2.2000 -0.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -2.3780 -2.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -2.2280 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 0.8820 -3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 1.7650 -5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 0.1620 -3.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 -0.7330 -1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 0.1880 -5.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 1.7090 -4.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 1.7050 -6.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5860 -2.1700 4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -0.6930 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -2.0510 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -3.1230 4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 -6.9180 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -9.2460 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -9.7530 4.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4410 -7.9490 5.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -1.8430 1.2220 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 4 1 0 0 0 0 2 7 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 55 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 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 40 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 55 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 M END