IBS-ZINC01826610 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2100 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 0.0200 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 1.4000 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 3.5700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 4.3010 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 6.0060 0.0160 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 5.5620 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 4.2650 0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 6.5130 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 7.8550 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7860 8.7340 0.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5410 10.1120 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 10.5850 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 11.9450 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 12.8420 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 12.3710 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 11.0060 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4110 13.2350 0.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 14.5850 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8730 15.0470 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 14.1790 0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 6.0250 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 5.6380 0.0640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -2.0330 -0.0200 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -0.5130 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 1.9470 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 3.9090 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 8.2230 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 8.4040 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 9.8900 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 12.3110 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 10.6380 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 15.2250 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 14.6320 1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0440 14.9940 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 16.0710 0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 25 26 3 0 0 0 0 M END