MMs00688983 MOE2007 2D CORINA 3.40 0006 02.08.2006 47 50 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 0.7499 1.2991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2499 1.2992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2501 -1.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7501 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0003 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9000 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2499 1.2994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7499 1.2995 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9014 2.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0005 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7501 -1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7538 -2.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1241 -1.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9672 -0.3113 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4232 -2.5530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4233 -4.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7222 -1.8029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0213 -2.5528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3203 -1.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3202 -0.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6192 0.4473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9183 -0.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9184 -1.8026 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6194 -2.5527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4421 -3.8805 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.2501 -1.2987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4998 2.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2008 3.3485 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.2498 3.8976 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.7989 1.8486 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1499 2.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8499 2.3384 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8501 -2.3381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1501 -2.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1223 1.7097 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4582 2.4812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7221 -0.6029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2500 -3.4721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7927 -3.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2809 0.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6191 1.6473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9575 0.2975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6194 -3.7527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6501 -2.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 M END