NIH-ZINC04092950 MOE2007 3D CORINA 3.40 0006 02.08.2006 65 67 0 0 1 0 0 0 0 0999 V2000 0.0660 2.1010 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 0.6130 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 0.1210 1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -1.2440 1.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -2.1200 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -1.6340 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.2640 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 0.2320 -2.1520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 0.3880 -2.7280 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5910 1.4160 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 -0.5470 -3.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.1400 -5.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -0.9960 -6.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -2.2640 -6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -2.6700 -4.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -1.8090 -3.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -3.1070 -7.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 0.0620 -1.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -0.3410 -0.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8030 0.2170 -1.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8110 -0.1000 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0850 0.7000 -1.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -1.5960 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 0.5650 -2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 0.9950 -4.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 0.4050 -2.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3940 0.8520 -3.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7710 0.6910 -2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 0.2620 -1.5850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8580 1.0250 -3.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 0.7660 -2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 1.2130 -3.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5100 0.9500 -3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6110 0.2450 -1.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4590 -0.1680 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2700 0.1020 -1.7990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 2.4970 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 2.3010 -0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 2.5800 0.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3350 0.8020 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -1.6260 2.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -3.1850 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.3180 -1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 0.8470 -5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 -0.6770 -6.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -3.6570 -4.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4970 -2.1230 -2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -3.0340 -7.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0780 0.5380 -2.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4270 0.1590 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 0.4410 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 0.4650 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 1.7660 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -2.1670 -0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -1.8320 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5130 -1.8560 -1.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 1.0170 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.6410 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 0.2400 -4.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 1.8980 -3.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7530 1.4450 -4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1360 1.7580 -4.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3960 1.2840 -3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5790 0.0230 -1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5320 -0.7160 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 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 57 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 27 60 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 62 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 35 2 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 35 65 1 0 0 0 0 M END