NIH-ZINC04041202 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 1.9820 3.3520 -3.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3350 2.2230 -3.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2760 1.3050 -3.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 1.5810 -2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 2.6900 -1.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 3.6010 -1.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 2.5830 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0540 1.4320 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7660 0.8170 -1.6160 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0420 0.8490 0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3430 1.3540 1.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7450 -0.4050 -0.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1850 -1.2660 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6680 -1.4300 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2890 -2.0530 1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1280 -0.8050 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0690 -0.1650 -0.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0210 -0.7450 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 1.2720 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 2.1820 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1160 3.4950 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 3.8710 -1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2100 2.9120 -2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 1.6270 -2.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5230 -0.8540 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8180 -2.1570 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3000 -2.2780 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1100 -3.9410 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3730 -5.3640 -2.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8290 -5.5610 -3.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4120 -5.3710 -3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0470 -3.9470 -3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -1.8110 1.9410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 4.0490 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 2.0540 -4.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 0.4270 -4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 4.4810 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3300 3.2660 0.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 1.8900 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5430 4.2220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9080 4.8880 -2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 3.1560 -3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7630 0.0130 -1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1410 -0.8020 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5030 -3.0090 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2130 -2.1900 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6170 -1.5560 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9010 -2.1370 -0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4660 -3.8080 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5700 -3.1980 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4520 -5.5420 -2.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9500 -6.1080 -1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0630 -5.5580 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9390 -6.1130 -3.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4870 -3.2070 -4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9610 -3.8290 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 -1.0210 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6100 -3.6680 -2.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 12.1790 -4.3360 -1.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 1 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 33 2 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 58 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END