NIH-ZINC02876131 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 48 0 0 0 0 0 0 0 0999 V2000 0.3230 0.9750 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -0.5430 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -0.8550 -0.4110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.2550 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 -2.4700 -2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -3.9690 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2600 -4.1740 -3.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -5.6740 -4.1360 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -5.5540 -5.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -6.1370 -3.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -6.7420 -4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 -6.8810 -5.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 -7.7170 -5.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -8.4200 -4.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -8.2780 -3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -7.4440 -3.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 -9.2670 -4.3470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1910 -9.9350 -5.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -9.8770 -6.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -10.7380 -5.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7300 -11.4310 -6.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 -12.1790 -6.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7480 -12.2420 -5.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4550 -11.5580 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -10.8120 -4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 1.3660 0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 1.4280 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 1.2130 2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -0.9960 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6670 -0.9340 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -2.7440 0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -2.6810 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -1.9810 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -2.0440 -2.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -4.4570 -1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -4.3950 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 -3.4320 -4.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 -6.3350 -6.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -7.8250 -6.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 -8.8230 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -7.3370 -2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4670 -9.3740 -3.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -11.3820 -7.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1210 -12.7160 -7.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6520 -12.8290 -5.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1320 -11.6110 -3.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -10.2820 -3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 M END