NIH-ZINC01104301 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 60 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 -0.6990 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0760 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7820 0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0740 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6740 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -3.0770 -2.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -4.2980 -1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -4.1290 -0.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -5.2120 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -5.6090 1.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8990 -4.7290 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -6.6520 2.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -6.9440 2.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5120 -7.9060 2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -7.8890 2.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 -6.9140 3.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -6.2980 3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1020 -5.2550 4.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0510 -4.8340 5.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -5.4450 5.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6050 -6.4680 4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -8.8530 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -6.1610 -0.0790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -5.5500 -2.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2770 -6.7060 -1.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -7.8740 -2.6840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -5.3880 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -4.1680 -4.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.8910 -3.7430 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 -0.1540 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.6070 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1260 -2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -6.0730 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -4.8750 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -7.5660 1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -6.2640 3.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 -4.7760 4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -4.0230 6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 -5.1050 6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5760 -6.9370 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -9.7520 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -9.1240 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -8.3700 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -6.9490 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -8.6870 -2.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -6.2800 -4.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -5.2360 -4.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 -4.2930 -4.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -4.0850 -5.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.6840 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -2.0560 -4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 M END