NIH-ZINC02938752 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6060 -0.6070 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6610 -1.9920 -1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 -2.6020 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8350 -1.8350 -3.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 -0.4550 -3.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 0.1610 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -2.5030 -4.3820 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7680 -3.5270 -4.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 -2.5180 -5.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -3.2940 -6.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -3.7860 -6.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 -3.4400 -7.8700 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -4.1940 -8.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -5.2790 -9.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -4.6350 -9.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -3.9480 -8.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -2.8550 -8.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -3.6730 -10.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -4.0870 -11.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -5.0050 -11.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -5.6490 -10.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7180 -1.7640 -4.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1850 -2.2400 -4.1350 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1510 -1.3560 -4.6860 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0040 -2.4210 -2.7380 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5310 -3.8330 -4.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 -3.9470 -5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -5.1950 -6.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 -6.3350 -5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -6.2190 -4.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -4.9680 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3410 -7.5640 -6.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8840 -8.6940 -5.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -2.5910 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -3.6800 -2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.1420 -3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 1.2380 -2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6090 -2.9900 -5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -1.4950 -5.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -3.5190 -9.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -4.6570 -8.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -5.7800 -10.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -6.0060 -8.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -3.5050 -8.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -4.6810 -7.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -2.4350 -7.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -2.0710 -8.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 -3.2260 -12.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3510 -4.6430 -12.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -4.4190 -10.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 -5.7370 -11.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 -0.9950 -5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -3.0580 -6.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0230 -5.2830 -7.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -7.1050 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 -4.8770 -3.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1610 -9.6100 -6.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3420 -8.6850 -4.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -8.6480 -5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 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 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 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 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 19 52 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 24 25 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 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 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 34 1 0 0 0 0 32 33 1 0 0 0 0 32 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 M END