MMs01956051 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 42 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 0.7594 -1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0188 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5812 -1.5588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7782 -3.8916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0377 -5.1960 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2729 -6.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0494 -6.3034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4153 -5.6834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2477 -4.1928 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7197 -6.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0133 -5.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3177 -6.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3286 -7.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0350 -8.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7306 -7.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4623 -5.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2029 -6.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7028 -6.5222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4622 -5.2286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7217 -3.9242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2217 -3.9133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4811 -2.6089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4434 -7.8266 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0349 0.6075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6075 1.0349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0349 -0.6075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -0.5156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6842 -2.0582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0837 -7.0158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6569 -7.3383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0046 -4.4646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3526 -5.7976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3721 -8.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0437 -9.8645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6957 -8.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5954 -7.5462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6622 -5.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3292 -2.8893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 M END