NIH-ZINC04039079 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 62 0 0 1 0 0 0 0 0999 V2000 2.7890 0.8480 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4420 -0.6110 2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -1.1460 2.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -2.5120 2.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -3.5290 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 -4.8070 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 -5.0950 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1040 -4.0800 2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -2.7600 2.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 -1.6020 2.5390 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -0.4330 2.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 1.0230 2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 2.0740 1.9230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4400 1.9930 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 3.3700 2.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 3.1340 3.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 3.9910 4.7350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 1.6800 4.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 1.0970 5.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3330 4.6870 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 5.1200 2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 6.9950 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 8.3930 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 8.3130 -0.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 7.7780 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 6.3740 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 1.9160 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 1.4480 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 1.3160 -0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 1.6300 0.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 2.0790 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 2.2320 2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 -1.0280 2.7280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8150 1.1090 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 1.0360 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 1.4540 2.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -3.3140 2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -5.6060 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5310 -6.1150 2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1620 -4.2900 2.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 5.4120 2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 4.6330 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 4.3950 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 5.1740 3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4390 7.0590 2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 6.3480 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 8.7850 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 9.0540 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 7.7250 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 8.4210 -0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 5.7170 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 5.9850 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0370 1.1890 -0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3300 0.9520 -1.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9330 2.3270 2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 2.5950 3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 1.7250 6.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 6.4410 1.4560 N 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 33 2 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 27 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 57 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 21 58 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 58 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 M END