IBS-ZINC06757511 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.1060 1.4730 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 -0.0560 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.5430 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -2.0420 1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.6800 0.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -4.3950 0.8590 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -4.2410 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -2.9370 2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -2.4920 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -2.1430 4.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -5.2900 2.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -6.5400 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -6.7460 1.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -7.6710 3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4840 -7.4900 4.0600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -8.8940 3.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -10.0070 4.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -10.6180 4.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -11.0080 3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -9.7590 3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -9.1370 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -1.9800 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -0.5720 -0.2590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 -0.5500 -1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 1.8660 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 1.8190 -1.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 1.8250 0.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -0.3350 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 -0.0380 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1250 -5.1250 3.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -10.7640 3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -9.6380 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -11.5040 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -9.8880 5.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -11.7190 3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6180 -11.4650 4.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -10.0340 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -9.0370 3.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -8.1940 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -9.8210 1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 -2.1900 -1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -2.3290 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -0.1580 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9950 -1.6400 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.2040 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -2.4710 2.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -2.1700 3.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 22 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 9 10 2 0 0 0 0 9 46 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 46 47 1 0 0 0 0 M END