MMs02557279 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 43 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 -0.2408 -1.4805 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8154 -2.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1288 -3.8793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3517 -3.6384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5802 -2.1559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9138 -1.4694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2532 -2.1447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3094 -1.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6228 0.2540 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1631 1.3255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1423 0.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7919 -1.3081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3353 -2.7062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7310 -0.1384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2135 -0.3669 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1526 0.8028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6351 0.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5742 1.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0567 1.5155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6001 0.1174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0826 -0.1110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0217 1.0586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4783 2.4567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.9958 2.6852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1785 -0.8238 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.1844 -0.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1927 1.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1844 0.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0014 -2.3629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6691 -4.9508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2038 -4.4834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4459 -3.3292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2963 0.9800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7179 1.9213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1395 2.8625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8488 -0.8183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.5173 -1.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2077 0.8759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2296 3.3925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.5611 3.8037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 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 34 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END