IBS-ZINC05022499 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.4810 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.0260 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -0.6240 -0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1710 -0.7090 -0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -2.1750 -0.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8780 -2.5800 -1.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.4020 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -1.0050 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -0.1440 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -0.6780 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 -1.7010 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1320 -1.3920 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5420 -0.0640 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6050 0.9580 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 0.6600 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3350 1.6600 0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8410 2.0320 1.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1440 1.4200 2.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 3.2130 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8670 0.2330 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7790 -0.8670 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -2.7910 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -3.9760 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -4.5430 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -3.9220 3.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -2.7330 3.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -2.1670 2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 -4.4780 4.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -3.7840 5.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0030 1.8520 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.8600 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.8190 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1590 -2.9220 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -2.9620 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 -2.7340 -0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 -2.1830 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9290 1.9880 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4900 4.1210 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 3.0680 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 3.3040 0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6410 -1.4540 -0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5900 -1.4950 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8010 -0.4920 0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -4.4590 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -5.4680 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -2.2480 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2720 -1.2400 2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -2.7860 5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -3.7020 5.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5610 -4.3330 6.4060 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 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 37 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 19 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 M END