MMs00720864 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4173 0.4912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5513 -0.4907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4235 -1.9852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2274 -2.8903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4131 -4.3788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7950 -4.9622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9912 -4.0571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8054 -2.5686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7873 -1.4346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0122 -0.1504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7368 1.1630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2365 1.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0116 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2870 -1.4055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5114 -0.0630 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2360 1.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4609 2.5346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7357 1.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5108 -0.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0105 0.0245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7351 1.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9600 2.6220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4603 2.5929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6847 3.9354 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.3929 1.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1338 -0.3929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3929 -1.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8335 1.5395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3484 1.2482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1218 -2.4236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4562 -5.1029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9436 -6.1529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0967 -4.5238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1167 2.1904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8162 2.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9071 -2.4328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1314 -1.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9311 -1.0554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6306 -1.0029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9349 1.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8402 3.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 42 1 0 0 0 0 M END