NIH-ZINC04092403 MOE2007 3D CORINA 3.40 0006 02.08.2006 70 72 0 0 1 0 0 0 0 0999 V2000 -2.6110 0.9400 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 -0.3030 -4.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -1.4250 -5.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -2.6940 -4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -2.9650 -3.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -4.0400 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -4.7830 -2.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -4.3200 -1.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9950 -3.5270 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6270 -4.3730 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4720 -3.3540 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 -3.4010 -1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3140 -4.4720 -2.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4640 -5.4930 -2.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -5.4390 -2.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6340 -4.5200 -2.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0780 -5.6530 -3.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -5.6040 -0.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1810 -6.6410 -1.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6930 -6.8050 -1.3270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5680 -7.1480 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -7.8200 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 -7.0220 -2.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -5.8610 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -5.5520 -1.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 -5.8330 0.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 -4.9740 1.2560 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -7.1540 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7480 -7.1530 2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 -8.4740 3.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -9.3330 2.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4720 -8.7030 4.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 -9.9000 5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 -10.1910 6.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -11.3840 6.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -12.2470 6.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -11.8940 4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -10.7520 4.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 1.1420 -5.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 0.8840 -5.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 1.7410 -4.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -1.5290 -5.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -1.2720 -6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9430 -3.5340 -5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -2.5550 -4.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -2.3710 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0820 -2.5210 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4730 -2.6050 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8510 -6.3280 -3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4590 -6.2320 -2.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5460 -5.6920 -4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8800 -6.5640 -2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1490 -5.5670 -3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -7.5850 -1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3010 -6.3510 -2.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -8.6650 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -8.1610 -3.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9630 -7.6320 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -6.6420 -3.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -6.1850 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -5.0000 -2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 -7.9590 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -7.3060 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1830 -6.3480 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -7.0010 2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -8.0340 5.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8660 -9.4960 7.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0550 -11.6360 7.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -13.1850 6.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -12.5620 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 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 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 5 6 1 0 0 0 0 5 46 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 60 1 0 0 0 0 24 61 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 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 64 1 0 0 0 0 29 65 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 32 66 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 67 1 0 0 0 0 35 36 1 0 0 0 0 35 68 1 0 0 0 0 36 37 2 0 0 0 0 36 69 1 0 0 0 0 37 38 1 0 0 0 0 37 70 1 0 0 0 0 M END