NIH-ZINC02871360 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 2.5600 0.3840 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 -0.9750 0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8180 -1.9270 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -3.1730 0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -3.4690 0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -2.5100 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -1.2680 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4670 -4.7280 -0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -4.8640 -1.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8370 -5.9080 -1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 -4.0030 -0.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.4100 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9840 -3.6260 -2.3790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -4.8750 -3.5340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -4.5390 -4.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -5.8360 -5.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8280 -6.5780 -5.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -6.9820 -4.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -5.7370 -3.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -7.6860 -6.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -8.6800 -6.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -9.7730 -7.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -9.8800 -8.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -8.8930 -8.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -7.7970 -7.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -6.8290 -7.9930 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -7.0100 -9.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9860 -6.0670 0.8240 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -7.1240 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 -5.6860 1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -6.2730 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4270 1.0540 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 0.7850 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 0.2940 1.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8520 -1.6960 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -3.9160 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8670 -2.7380 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.5240 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -2.9490 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -4.2150 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -4.2300 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -3.8830 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -4.0400 -4.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8040 -5.5980 -6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -6.4450 -5.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -7.5760 -4.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 -7.5760 -3.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -6.0310 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -5.1990 -4.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -8.5990 -5.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -10.5460 -6.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -10.7350 -8.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9330 -8.9800 -9.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -7.0640 -10.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 -7.9340 -9.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8360 -6.1680 -9.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 -6.2690 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -7.2210 2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -5.4540 2.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 50 1 0 0 0 0 22 23 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 2 0 0 0 0 28 31 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END