IBS-ZINC02252657 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 0 0 0 0 0 0999 V2000 1.3180 -0.1160 3.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -1.4440 2.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -1.6620 2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5140 -2.9270 1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 -3.1460 1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6550 -2.1060 1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3220 -0.8440 1.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0870 -0.6210 2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -2.3480 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 -2.7380 1.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -1.8910 2.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5420 -2.7590 3.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4300 -2.2260 4.1430 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6290 -0.9050 4.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5720 -0.3250 5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7680 1.0210 4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0470 1.8410 4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 1.3180 3.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -0.0700 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9930 -0.5940 2.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1170 -4.0160 3.0840 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2050 -4.0110 2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -5.2190 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 -6.2580 2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -7.3820 2.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -7.4830 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -6.4540 -0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2250 -5.3280 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -8.5870 0.1950 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.0800 3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 0.5730 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 0.1720 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -3.7400 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -4.1310 1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -0.0320 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 0.3640 2.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3490 -1.4350 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9260 -3.1450 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1390 -0.9470 5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4920 1.4600 5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2210 2.9070 4.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 1.9660 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4260 -6.1800 3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 -8.1870 2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3480 -6.5380 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4870 -4.5290 -0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 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 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 M END