IBS-ZINC04028969 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0410 1.0770 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 1.2010 2.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 2.0740 3.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2280 2.1040 3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 2.5360 4.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 2.5840 4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 2.1950 3.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 1.7620 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9080 1.7150 2.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 1.2290 1.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2540 0.1430 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8450 1.8340 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 3.3580 0.1220 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6720 3.6320 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 3.9440 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 4.2320 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 4.7690 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 5.0200 -3.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 4.7310 -2.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 4.1890 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 5.5490 -4.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 5.7820 -4.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 3.8670 1.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 1.3810 1.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4400 0.0330 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3440 2.3320 3.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4510 3.1920 5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 2.9640 5.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.0120 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 1.4380 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 1.3980 -0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 1.3220 2.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 0.1560 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4130 1.6680 4.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3360 3.0880 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 2.8380 5.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 1.4560 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 1.5580 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 4.0360 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 4.9940 -4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0950 4.9260 -2.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2660 3.9590 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 6.2040 -5.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 4.8390 -4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 6.4780 -4.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4220 3.6070 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8770 -0.1650 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 -0.6490 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1950 -0.1150 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5270 4.2350 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3070 2.9100 5.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 1.6260 1.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 52 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 M END