IBS-ZINC05399385 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 0 0 0 0 0 0999 V2000 -2.4800 -1.8340 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -2.2010 4.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -1.0780 3.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -1.5830 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 -2.3560 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -3.3240 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7100 -3.3000 1.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8600 -4.1390 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -3.8030 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 -4.5700 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -5.2820 3.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -6.0090 4.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 -6.0420 4.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -5.3390 3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -4.6220 2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0110 -3.9850 1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -4.2880 1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4240 -3.8380 1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5220 -2.9670 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6830 -2.4920 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7710 -1.6080 -1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8150 -1.7950 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9350 -0.9630 -3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 0.0710 -3.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 0.2790 -2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 -0.5540 -1.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 -5.1600 3.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -5.6230 3.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -5.2300 2.8950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -2.7270 5.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -1.0880 5.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -1.4480 4.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1280 -0.6380 2.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -0.3220 3.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.8190 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 -1.9380 2.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -2.3200 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -1.3520 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8060 -2.9990 -0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7610 -4.3430 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -3.7980 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5820 -5.1770 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2860 -4.0810 2.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -3.2730 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -4.5110 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -6.5510 4.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4540 -6.5920 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3490 -4.1270 1.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5900 -2.7060 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6280 -2.7640 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 -2.5950 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 -1.1210 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 0.7180 -4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2900 1.0940 -2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -0.3620 -0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -5.7090 3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -2.7650 1.4130 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4960 -3.2370 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 9 57 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 13 14 2 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 29 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END