IBS-ZINC04023510 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 0 0 0 0 0 0999 V2000 0.2490 1.6450 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 0.1340 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 -0.4930 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -2.0110 -1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.5080 -2.1440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -3.8580 -2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2930 -4.2830 -3.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -5.6360 -3.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -6.5870 -3.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 -6.1590 -1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -4.8030 -1.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -8.0470 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8310 -8.6880 -2.7450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0820 -10.0360 -2.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -10.7680 -3.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2920 -10.4950 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -11.9820 -2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -12.3840 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 -13.8700 -1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3780 -14.2380 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8160 -15.7040 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 -16.4750 -1.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 1.9230 0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 2.0970 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 2.0740 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.2830 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.1090 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -0.0720 -2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -0.2440 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -2.4380 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.2610 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -3.5540 -4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -5.9410 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -6.8810 -1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -4.5220 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -8.5670 -3.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -8.1790 -4.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4290 -8.1300 -2.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1550 -9.9010 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1120 -10.2710 -1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7240 -12.5740 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -12.2070 -3.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 -11.7850 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 -12.1530 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2910 -14.4730 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3280 -14.1050 -2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 -13.6280 -1.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1910 -13.9970 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8380 -15.9630 -0.1590 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 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 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 M CHG 1 49 -1 M END