NIH-ZINC01053452 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 0 0 0 0 0 0999 V2000 0.1760 1.0040 -1.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -0.2070 -0.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0940 -0.8490 -0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.4090 -1.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2420 -1.9780 0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -2.5840 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 -3.9660 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -4.5610 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9850 -3.7820 0.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 -2.4060 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.8050 0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5680 -4.5450 0.4330 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.5010 -3.6300 -0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4100 -5.8770 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -4.6570 2.0450 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6610 -3.5450 2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0070 -4.0280 3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0400 -5.2790 3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0090 -6.4340 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5690 -6.9840 2.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5560 -5.8190 2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 1.4200 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.7680 -2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.7320 -1.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -2.3720 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -4.5750 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -5.6360 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7820 -1.8000 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5720 -0.7290 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 -3.2820 3.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7200 -2.6750 2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5500 -3.2340 3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5190 -4.2440 2.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1680 -5.3070 4.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9560 -5.3030 4.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6580 -7.2260 3.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3700 -6.1020 1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3470 -7.6490 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4920 -7.5410 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6160 -6.1970 2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3770 -5.5140 3.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 M END