IBS-ZINC00530911 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 0.0650 1.2440 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0060 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -0.5510 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 0.1540 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 1.4110 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.9530 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 2.1280 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 3.4720 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 4.0680 -0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8620 4.2350 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 6.0080 -0.3430 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1490 6.6380 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 5.9320 -0.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2760 6.7070 -0.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8810 7.9600 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5050 7.9530 -0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6710 9.0340 -0.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7450 9.1440 -0.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0600 9.1400 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4850 10.4830 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4220 11.2330 -0.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3710 10.4220 -0.5770 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 -0.3780 1.1470 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 1.6640 -1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -1.5270 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.9290 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 1.6570 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 4.0400 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3900 3.9150 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4980 9.3910 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0410 9.7540 -1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6610 8.2750 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4750 10.8440 -1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4150 12.3090 -0.6880 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 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 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 M END