IBS-ZINC04807211 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 25 0 0 0 0 0 0 0 0999 V2000 0.0450 1.0760 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 1.5850 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 1.6640 -1.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9320 2.0060 -2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 2.2300 -3.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 2.0650 -2.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 1.8200 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 1.8890 -0.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 1.5040 0.1100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 1.4030 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 1.1090 1.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 1.9640 -2.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 1.7620 -2.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 2.2670 -3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 2.7460 -4.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 0.0920 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 1.0010 -0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 1.7660 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8200 2.2890 -2.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 1.3390 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 2.3700 -3.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 2.3100 -1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 0.7000 -2.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1080 2.1850 -4.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3600 2.5210 -5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 10 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 19 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 14 15 2 0 0 0 0 14 24 1 0 0 0 0 24 25 1 0 0 0 0 M END