IBS-ZINC05216221 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 0.0600 1.5640 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.1400 0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 -0.3840 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 0.4550 2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.0800 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -1.4500 3.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -2.2890 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -1.7580 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -2.6720 0.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9440 -2.3440 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -2.6400 -0.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9490 -3.2230 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -1.1900 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -1.1450 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8860 -1.7300 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -3.1810 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -3.2360 0.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0730 -4.6930 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -4.7460 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -4.0470 0.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -4.6590 0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -4.1160 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -5.9920 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 -6.2320 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -7.4780 3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -8.4900 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 -8.2600 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -7.0160 0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -6.7270 -1.1550 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -2.4850 1.3100 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 1.9300 0.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.8490 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.9990 0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 1.5260 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7720 0.5730 4.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -1.8670 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -3.3590 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -0.7710 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.6060 -0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 -1.7300 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 -0.1110 -2.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -1.6960 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -1.1470 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -3.7620 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -3.5990 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -5.2600 -0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 -5.1240 0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -5.7840 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -4.2550 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -5.4440 3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -7.6640 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -9.4630 2.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8820 -9.0540 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -2.8080 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 20 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 30 54 1 0 0 0 0 M END