NIH-ZINC06551928 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 63 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6170 -5.6180 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -6.3980 -0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -5.5230 -2.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -4.5800 -3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6840 -5.2740 -4.2840 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2590 -6.1390 -4.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -4.2880 -5.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -4.2370 -5.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 -5.5590 -5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -5.6900 -3.8620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 -6.3630 -1.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 -5.6450 -1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6150 -4.5400 -0.7030 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0310 -6.2300 -0.9520 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0680 -5.5320 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3000 -6.3960 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4530 -7.2860 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5840 -8.0780 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5600 -7.9810 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4080 -7.0910 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2790 -6.2950 -1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -3.7040 -1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -4.9640 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 -4.2410 -3.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 -3.7240 -2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 -4.6600 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -3.3020 -5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -4.2280 -6.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 -3.3750 -5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -6.3990 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 -5.4850 -4.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1330 -6.5690 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 -7.3020 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2060 -7.1140 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7020 -5.3270 0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3140 -4.5930 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6900 -7.3620 1.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7030 -8.7740 1.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4430 -8.6010 0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1710 -7.0150 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1620 -5.5970 -1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 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 39 1 0 0 0 0 7 40 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 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 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 59 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 M END