MMs00178221 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 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 1.3051 0.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9031 0.7182 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9031 -0.4818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9153 2.2182 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6224 2.9787 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5832 3.5787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3173 2.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6346 4.4787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2204 2.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2326 4.4575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5133 2.1970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8885 2.7959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8831 1.6731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1226 0.3802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6579 0.7040 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3761 1.8177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9974 3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4904 3.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3622 2.1070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7409 0.7417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2479 0.5971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6267 -0.7682 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5915 1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 -0.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5915 -1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2659 1.3394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8192 -0.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3618 -0.9467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1339 2.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9161 3.3703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8346 4.4689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6444 5.6786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4347 4.4885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1476 3.9676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3000 4.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9874 4.4199 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5566 2.2227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4383 -0.2348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5875 -1.0766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2303 -0.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8044 0.9920 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 9 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END