MMs01646534 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 0.7484 -1.3000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4516 -1.3000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 -1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9968 -2.6018 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2451 -3.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7451 -3.8980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3451 -4.9373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0032 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0065 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4968 -2.6037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2451 -3.9036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2484 -1.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7484 -1.3074 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 -0.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7484 -1.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2484 -1.3130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 -0.0149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2516 1.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7516 1.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0032 2.5869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5032 2.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7516 1.2906 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9968 -2.6130 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 0.5987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5987 1.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -0.5987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0415 -0.1198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3765 -0.8928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3723 -4.3117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0353 -5.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -4.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6078 -6.2346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0320 -5.7974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1213 -0.8937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4582 -0.1241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1471 -2.3497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2000 -0.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8529 2.3235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9045 3.6287 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 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 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 10 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 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 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 M END