IBS-ZINC05025563 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -5.9020 7.5580 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 7.0260 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 5.7430 -0.1060 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 7.0980 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 5.6280 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 6.8660 -1.4340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2830 7.7490 -0.5460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 4.1260 -1.9130 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 2.9960 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 2.0380 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 1.8410 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1060 1.4330 0.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.2500 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 1.4690 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.8740 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 2.0540 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3770 1.2860 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 1.6370 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 1.3690 -0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 0.1330 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4670 -0.1150 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2740 0.8760 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 2.1130 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3950 2.3600 -0.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5850 0.6350 -0.3070 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.1420 3.0930 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8780 2.3130 -0.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3600 7.4960 2.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 8.5980 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8150 6.9660 1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 1.4200 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 1.2640 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 0.9360 1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 2.0430 -2.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 2.3640 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 1.0410 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 2.6950 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -0.6400 -1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8860 -1.0800 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3640 2.8870 0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9760 3.3270 -0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 4.0460 -2.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6240 4.0700 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 42 43 1 0 0 0 0 M END