IBS-ZINC00989248 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3730 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 1.2360 -0.5520 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4440 0.7270 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 1.9570 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -1.9980 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -2.4310 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -3.7970 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -4.6940 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -4.1740 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -2.8670 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -5.2720 -0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.0110 -4.0750 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -4.8080 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -5.1590 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -5.8310 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7160 -6.1380 0.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1660 -5.8200 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9620 -5.1430 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -6.1090 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -7.2310 -0.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 -4.2960 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 -3.7980 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7250 -4.2660 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1240 -5.2300 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 -5.7280 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -5.2630 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3950 -5.6860 -0.1090 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.9400 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -0.5990 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 3.0230 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6610 -1.7150 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -3.4540 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -3.4450 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4720 -4.9110 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -6.1080 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6650 -6.0890 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5200 -4.8820 -2.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -3.0470 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4300 -3.8810 -1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -6.4800 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -5.6480 1.5820 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 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 31 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 20 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 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 3 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 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 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 41 1 0 0 0 0 27 42 1 0 0 0 0 M END