NIH-ZINC04039838 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 0.8820 1.8460 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 1.3160 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 0.0020 -1.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -0.6090 -2.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 -0.0580 -2.6850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -1.9380 -2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -2.6610 -3.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3630 -3.8750 -4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 -3.8360 -3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -2.6730 -2.7000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.3920 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -4.9180 -3.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -4.9700 -4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2080 -5.2580 -6.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -4.4720 -6.7320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2240 -4.4450 -6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -5.1690 -7.9750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -6.2460 -8.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 -7.0310 -9.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -6.3340 -6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -7.1940 -6.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -4.7580 -8.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -3.8950 -10.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -2.3770 -11.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -4.4960 -11.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -3.0700 -7.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9000 -2.7810 -7.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3260 -1.4960 -7.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 -0.4930 -7.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -0.7760 -7.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -2.0710 -7.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -2.3550 -7.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -2.0990 -6.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 0.2100 -7.7740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 1.5140 -8.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -5.6940 -4.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -2.2460 -4.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.9170 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7360 1.1650 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 2.8320 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 1.9970 -1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9250 1.2450 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -5.5630 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 -4.4650 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -5.5100 -4.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -5.6420 -9.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -4.1830 -8.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -3.0530 -9.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0330 -4.4940 -10.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5870 -2.8120 -12.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -1.5400 -11.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -2.0230 -12.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8040 -5.2000 -10.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -5.0080 -12.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 -4.0970 -12.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 -3.5620 -6.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -1.2750 -7.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 0.5100 -7.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8840 -2.6210 -5.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -1.0280 -5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -2.4540 -6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 1.8570 -7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.4750 -8.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 2.2030 -8.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -6.3910 -5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 -2.4930 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -2.7720 -5.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 -1.1710 -4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -3.3940 -10.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 41 1 0 0 0 0 2 42 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 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 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 69 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 69 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 69 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 35 64 1 0 0 0 0 36 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 37 68 1 0 0 0 0 M END