NIH-ZINC06492390 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 4.2200 -0.8670 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -2.1780 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -2.4350 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 -3.7270 0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -4.8780 1.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -6.0800 0.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -6.0520 -0.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2940 -4.9150 -1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -3.7430 -0.5890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -4.9130 -2.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -6.0110 -2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 -7.1120 -1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 -8.3930 -2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -9.5080 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -10.7710 -1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -10.9260 -3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -9.8180 -4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -8.5520 -3.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -6.0470 -3.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9260 -6.8910 -3.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2760 -7.5610 -2.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -7.0020 -5.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9470 -7.2270 -5.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -5.6780 -5.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -8.0750 -4.9470 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -9.2060 -5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 -9.4960 -6.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7800 -10.0390 -5.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 -11.2760 -5.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4120 -11.7880 -5.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1040 -11.0720 -4.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -9.8340 -3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4850 -9.3090 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7200 -8.0610 -4.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0090 -7.1700 -3.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -7.1330 1.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1370 -0.6830 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -0.0460 0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -0.9360 1.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 -2.1080 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2860 -2.9980 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.5050 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -1.6150 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -4.8860 2.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 -7.0060 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -9.3870 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -11.6380 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -11.9150 -3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -9.9430 -5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 -7.6860 -4.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -5.4650 -4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -5.4530 -4.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -4.8800 -5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 -5.7580 -6.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -11.8390 -6.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7800 -12.7520 -5.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0080 -11.4820 -3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1890 -9.2790 -3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.9190 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 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 44 1 0 0 0 0 6 7 1 0 0 0 0 6 36 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 59 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 34 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 32 33 1 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 M END