IBS-ZINC02414475 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 0.2350 2.1910 -0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.6950 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.1020 -1.0720 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1880 0.2390 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 -1.5900 -0.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0840 0.1010 -1.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 0.6210 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 0.8230 -2.3240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7740 0.5220 -1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2390 -0.0180 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8460 -0.2250 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3440 -0.6890 0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3660 -0.2430 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5270 0.1860 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 0.6360 -1.1680 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 1.1620 -2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1860 2.6750 -2.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2060 3.1530 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 3.2650 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8900 4.3660 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4040 4.3110 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8920 2.9710 -0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7100 0.1040 0.6520 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8160 -0.3820 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0690 -0.4770 2.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 -0.9750 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 -1.3950 4.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 -1.3190 3.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 -0.8090 2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4590 -0.7240 2.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 0.9790 -3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 2.4110 -0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 2.4690 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 2.7580 0.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 0.4170 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0190 0.4740 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 -1.7410 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -2.1570 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.9300 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 0.6880 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6330 0.9510 -3.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7310 2.5000 -3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4520 3.6960 -3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9560 4.1460 -2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6770 5.3420 -2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2350 4.4910 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6120 5.0420 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9620 -0.1570 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1170 -1.0470 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 -1.7870 5.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -1.6490 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 1.9780 -3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3690 0.9600 -4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 0.2590 -3.4790 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 35 1 0 0 0 0 2 36 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 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 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 30 2 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 23 24 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 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 M END