NIH-ZINC04356180 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 0 0 0 0 0 0999 V2000 1.0380 -0.5820 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.0070 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6400 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2470 -0.1360 0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.7780 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -1.9290 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -2.4330 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -1.7870 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8900 -2.5810 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0270 -1.8670 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -0.6550 0.1590 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3520 -2.5750 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6820 -1.3490 0.4140 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.5120 -0.6010 1.6100 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1710 -2.3760 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3830 -1.4890 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2550 -0.2830 0.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.6090 -2.0360 0.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.7880 -1.1740 0.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0250 -2.0270 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4770 -2.4290 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6120 -3.2120 2.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2950 -3.5920 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8430 -3.1890 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7110 -2.4020 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.5880 -3.6030 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.6920 -4.3850 -0.9010 F 0 0 0 0 0 0 0 0 0 0 0 0 -18.0250 -2.4630 -1.9410 F 0 0 0 0 0 0 0 0 0 0 0 0 -16.7380 -4.3460 -2.0840 F 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 0.0200 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.5960 -0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 -0.6070 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 0.7600 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 -0.3850 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -3.3280 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 -2.1770 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 -3.5470 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5180 -3.1910 -0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3460 -3.2070 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2660 -2.9970 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0940 -3.0130 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7120 -3.0000 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6920 -0.5530 1.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8640 -0.5360 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9430 -2.1320 3.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9640 -3.5270 3.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1810 -4.2040 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3600 -2.0840 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 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 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 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 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 M END