NIH-ZINC04096805 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.9780 -0.2400 3.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.2250 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4840 0.1330 1.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -0.6560 1.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0350 -0.0060 0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.1740 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -2.3120 0.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7630 -2.1500 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 -2.1600 1.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2270 -3.0310 2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -4.4890 2.3280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5520 -5.1390 3.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9950 -4.6970 1.0630 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0490 -4.5400 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 -3.7160 -0.0550 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5630 -3.8920 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5130 -3.8920 -1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -5.3010 -1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 -6.2950 -0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5080 -7.2550 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -8.1920 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 -9.3090 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5280 -7.6780 1.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 -7.1540 1.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -6.1240 0.5510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3160 -6.2550 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -4.8370 2.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -2.6290 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -0.3010 2.8870 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 0.1020 4.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 0.4210 4.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -1.2550 4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 0.6320 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 0.5770 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -0.9140 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -1.4440 -0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -2.9020 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -2.7640 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -3.7480 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2530 -3.1550 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -5.4570 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -5.4270 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -7.3440 -1.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -6.8710 1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6420 -8.4890 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -6.7060 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -7.9910 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -6.4200 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -7.0980 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -5.3400 -0.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -4.7620 2.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -2.6990 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -3.6070 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -1.9140 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7530 0.6470 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 27 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 M END