NIH-ZINC02877594 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 0 0 0 0 0 0999 V2000 -4.3890 1.3240 2.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3560 -0.1800 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -0.8420 2.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4040 -0.8460 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5300 -0.0850 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -0.7120 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -2.0920 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.8590 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -2.2400 0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -4.2530 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -4.9880 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -5.0400 -2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -4.5140 -2.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 -5.6700 -2.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4540 -5.7210 -4.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6670 -6.4890 -4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6100 -6.5410 -6.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 -7.5850 -6.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -7.7760 -8.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -6.8090 -8.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6590 -5.4000 -8.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -5.3810 -6.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0750 -5.0740 0.4760 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 -6.2210 -0.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -4.1020 0.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -5.5480 2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 1.6310 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 1.6920 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6250 1.7370 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 0.9940 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -0.1220 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9070 -2.5760 -1.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0360 -2.8340 1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -6.0020 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 -4.4830 -0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2450 -6.0900 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 -4.7070 -4.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5400 -6.2260 -4.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -7.5030 -4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5810 -5.9840 -4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7150 -8.3690 -6.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -7.5870 -8.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -8.8010 -8.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -6.8150 -10.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9090 -7.1100 -8.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 -5.1560 -8.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2130 -4.6760 -9.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2640 -5.4450 -6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8720 -4.4490 -6.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 -6.2930 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5060 -5.9670 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 -4.6690 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END