IBS-ZINC02447263 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3990 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -0.3790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 0.7460 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2680 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -1.7050 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -1.9320 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 -3.2480 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -3.4790 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0560 -2.5200 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8300 -1.3230 -0.0610 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2880 -2.9970 -0.0820 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 -4.3260 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 -5.1590 -0.1080 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8500 -5.0430 -0.0720 S 0 0 0 0 0 0 0 0 0 0 0 0 8.3870 -2.1280 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1140 -1.9520 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 -2.5470 2.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2720 -1.0350 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0260 -0.8500 2.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1060 0.0060 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4440 0.6840 1.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6980 0.5040 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6200 -0.3550 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5030 1.5220 1.0060 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8950 2.0280 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -0.6620 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 2.8470 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -2.5360 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -1.1010 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9650 -4.0800 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -1.6530 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7640 -1.3780 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6910 0.1490 3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9650 1.0350 -1.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0430 -0.4970 -1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 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 35 1 0 0 0 0 24 36 1 0 0 0 0 M END