NIH-ZINC00424562 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7420 -0.5130 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -2.0420 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.0650 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 -0.5350 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.9600 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -4.3730 1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -5.8280 1.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -6.3720 3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -5.6710 4.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 -7.8370 3.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -8.4820 4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -9.8640 4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -10.5490 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -9.9170 2.1230 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -8.5990 2.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5710 -7.9370 0.8390 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 -8.4470 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4970 -6.5970 0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6790 -5.8380 -0.7470 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -0.3560 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7780 -0.1730 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -0.1270 2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -2.4280 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -2.4070 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4270 -2.4460 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -2.4500 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.1500 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9530 -0.2120 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -4.2660 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -4.4410 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -3.8910 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -4.0660 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 -7.9210 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0620 -10.4030 5.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -11.6270 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -2.5010 1.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 41 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 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 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 M END