MMs01649555 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 53 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 3 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 1.3174 -2.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6225 -2.9787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9153 -2.2181 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 2.5980 0.0212 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 0.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5857 1.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0424 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5011 -0.6970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5133 -2.1969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 -0.6758 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5366 1.5778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0012 1.9017 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7618 0.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7672 -0.5141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2548 0.4642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1265 1.6849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6195 1.5403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2408 0.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7338 0.0304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6056 1.2510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9843 2.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4913 2.7609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8700 4.1262 0.0000 Cl 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 0.1339 -2.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9162 -3.3703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8587 -3.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -3.8916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3350 -3.3424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0954 -2.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7857 1.5310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 2.7211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3858 1.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1862 1.2424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0151 0.9765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5578 0.9891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9334 -0.6920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3376 -0.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5434 -0.8016 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2308 -1.0619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8000 1.1353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6817 3.5929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 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 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 M END