IBS-ZINC06427792 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.6240 0.3010 1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -1.0500 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -2.1890 2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -3.4530 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 -3.6060 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7480 -2.4610 -0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7880 -1.1980 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4200 -4.9890 -0.5340 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2730 -5.7530 0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -5.3340 -1.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 -5.6520 -2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -5.5370 -2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -5.7360 -3.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -5.1520 -1.4970 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 -4.9410 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5500 -3.5510 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -3.5020 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5310 -2.1880 -2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -5.9970 -3.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -5.1930 -0.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -4.5380 -1.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -5.7430 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 -6.9900 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -7.0860 2.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 -5.9430 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -5.0830 1.3960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 -3.8050 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -3.3680 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -4.2400 3.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6840 -5.4730 3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 -8.1560 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 0.4900 2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 1.0890 1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 0.3650 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -2.0980 3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -4.3170 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -2.5370 -1.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 -0.3290 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -5.7050 -1.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 -5.1090 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 -2.7560 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 -3.3590 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1650 -2.7000 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 -4.4820 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -3.3840 -0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1760 -2.2290 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1230 -1.3180 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -2.1790 -2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -6.1390 -4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -3.2020 0.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6210 -2.3860 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7250 -3.8660 4.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 -6.1250 4.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 -8.2530 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -9.0830 0.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -8.0550 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 -3.4350 -1.5590 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4570 -4.2270 -2.0860 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 2 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 57 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 57 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 57 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 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 2 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END