NIH-ZINC06553078 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 36 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1980 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0090 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 2.0930 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.8430 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5500 0.6840 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7230 -0.3950 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 -1.3190 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 0.6350 -0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 3.1760 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5610 3.4060 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 4.6930 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 5.6460 -0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9250 6.9430 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9670 7.3050 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5430 6.3590 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 5.0580 0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5380 6.9610 1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2930 8.3750 1.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6020 8.5000 0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1730 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 0.6160 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 4.0020 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 5.3680 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4800 7.6790 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5140 4.3260 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6650 8.7240 2.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2340 8.9260 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 M END