NIH-ZINC03648049 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3600 -0.5070 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.8400 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -2.5620 -0.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -2.4340 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -3.9610 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -4.5400 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -5.8780 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3340 -6.6040 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -6.4730 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5940 -7.9350 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 -8.6840 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8040 -8.1470 0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6260 -10.0270 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8730 -10.7700 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 -12.2480 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4310 -12.9320 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1600 -14.2880 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0360 -14.9590 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1840 -14.2750 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4590 -12.9200 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4310 -2.1110 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -2.1010 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -4.2850 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -4.2950 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9250 -3.9590 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2190 -6.1490 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2360 -6.1390 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7240 -8.3630 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4400 -10.5200 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4570 -10.5100 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -12.4080 2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0440 -14.8220 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8240 -16.0180 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0870 -14.8000 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 -12.3870 -2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M END