NIH-ZINC04077973 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 67 0 0 1 0 0 0 0 0999 V2000 2.9630 0.0610 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7960 -0.2430 -0.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0940 -1.5290 0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -1.8520 1.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9950 -2.7270 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 -0.6400 2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -0.8100 3.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 0.2810 3.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 1.5470 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 1.7210 2.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 0.6240 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 0.8300 0.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.0790 0.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -1.3370 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -1.4940 -1.6390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -0.4260 -1.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 0.3640 -2.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.1250 -3.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5180 0.6530 -4.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 1.9340 -4.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 2.4220 -3.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 1.6370 -2.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 2.7710 -5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1680 3.5510 -5.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 2.6700 -6.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 3.4020 -8.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 4.1740 -8.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7450 3.2480 -8.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 2.6610 -7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 1.8310 -6.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 3.8780 -9.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 3.1640 -9.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 3.8040 -9.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 5.1400 -10.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 5.7870 -9.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0250 -0.7140 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 1.0290 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 0.0830 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -2.3450 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9430 -1.3710 1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -1.7990 3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1670 0.1450 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 2.4010 4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 2.7110 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9330 -2.7610 0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -1.1150 -3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 0.2730 -5.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 3.4120 -3.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 2.0110 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 2.6960 -8.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 4.1000 -7.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 4.6330 -9.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 4.9500 -7.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 2.0230 -7.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 3.4580 -6.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 1.4920 -5.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 0.9720 -7.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1120 2.1260 -8.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 3.2750 -9.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9310 5.6680 -10.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 6.8260 -10.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 5.1500 -9.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 13 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 45 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 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 31 32 1 0 0 0 0 31 62 2 0 0 0 0 32 33 2 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 33 59 1 0 0 0 0 34 35 2 0 0 0 0 34 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 M END