NIH-ZINC04092787 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 70 0 0 1 0 0 0 0 0999 V2000 1.1760 1.2130 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -0.2700 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -0.7420 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6070 -2.1030 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -2.9900 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6820 -2.5180 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9280 -1.1580 -0.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1470 -4.4740 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1650 -4.7830 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -5.2120 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -5.9250 -1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -5.0800 0.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7380 -5.7990 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8480 -5.4780 0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4890 -5.9880 2.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 -5.7400 3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -4.7810 -0.9940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7310 -4.4720 -2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -3.8950 -2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 -2.4760 -3.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.0620 -2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -3.3830 -2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -5.3480 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -5.6580 0.5940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -5.5970 -1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3990 -6.1470 -0.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -6.3960 -1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 -6.1570 -2.9520 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6980 -6.8840 -1.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6980 -7.2150 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9470 -7.6150 -1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9300 -7.9410 -2.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6290 -7.8540 -4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3670 -7.4490 -4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4510 -7.1400 -3.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 1.5300 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 1.4360 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 1.7450 -0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -0.0490 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -2.4720 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -3.2120 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -0.7890 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5120 -4.5100 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 -6.8710 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -5.4890 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7790 -5.9400 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 -4.3980 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6090 -4.6650 3.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -6.1580 4.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -6.2080 2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 -5.3720 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -3.8450 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -4.5150 -3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -1.7970 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 -2.4960 -4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 -1.7170 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -1.2970 -3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 -3.5500 -3.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -3.3660 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -4.6620 -2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -6.3200 -2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 -7.0820 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -5.4240 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8500 -7.0060 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1470 -7.6720 -0.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9100 -8.2550 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3740 -8.1010 -4.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1280 -7.3800 -5.4970 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 40 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 17 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 64 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 65 1 0 0 0 0 32 33 1 0 0 0 0 32 66 1 0 0 0 0 33 34 2 0 0 0 0 33 67 1 0 0 0 0 34 35 1 0 0 0 0 34 68 1 0 0 0 0 M END