NIH-ZINC04039903 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 71 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -1.8460 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.5740 -0.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -2.4250 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -3.7560 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5730 -3.8660 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -2.5750 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0490 -1.7160 0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -0.7490 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5400 -2.2010 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3530 -5.1110 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0560 -5.4860 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9040 -6.7260 1.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7190 -6.7240 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4410 -6.6810 2.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9960 -5.5680 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2630 -5.2420 4.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1220 -4.7970 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5620 -3.7460 2.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3200 -7.6860 3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4740 -8.7580 3.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3920 -9.8080 4.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4080 -11.9810 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5140 -13.0540 6.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7960 -12.4850 7.4050 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 -11.3700 7.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8560 -10.2800 6.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -7.9590 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -8.6650 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 -9.7940 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -10.1750 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4910 -9.4790 2.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2310 -8.3970 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -5.8890 -1.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 -4.8940 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -2.1170 1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6760 -1.2460 -0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1170 -2.9700 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9680 -7.2080 4.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9300 -8.1470 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8260 -9.2360 3.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8640 -8.2970 4.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -9.3300 5.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0020 -10.2690 3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9140 -12.3950 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1490 -11.6520 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1310 -13.8790 6.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8080 -13.4210 5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4840 -10.9760 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2270 -11.6880 6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5720 -9.9230 7.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2300 -9.4510 6.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -8.3440 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -10.3680 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8770 -11.0530 0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1940 -7.8500 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -6.6860 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 -5.1750 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -5.7490 -0.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -4.5830 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5790 -10.8380 5.2700 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 30 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 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 68 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 29 59 1 0 0 0 0 29 68 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 34 2 0 0 0 0 33 62 1 0 0 0 0 34 35 1 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 M END