IBS-ZINC04025982 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 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 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -2.5930 0.0150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4180 -2.1600 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -4.1350 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -4.5610 1.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8090 -4.8850 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -3.3630 1.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5150 -2.2850 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -1.2530 1.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -5.6650 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7190 -5.4720 1.1390 O 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 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -2.4250 0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 -4.4660 -0.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -4.5220 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1090 -6.8620 0.5370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -7.5390 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 3 21 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 11 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 26 27 1 0 0 0 0 M END