MMs01515587 MOE2007 2D CORINA 3.40 0006 02.08.2006 35 37 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 1.2384 0.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1246 2.3421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3629 3.1885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7151 2.5392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 1.0436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5906 0.1972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0129 -1.2422 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5123 -1.2853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0166 0.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4560 0.5497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5413 -0.4857 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9807 -0.0634 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.5584 1.3760 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4030 -1.5027 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4200 0.3589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7739 1.8166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2133 2.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2986 1.2036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9447 -0.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5054 -0.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7380 1.6259 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.3587 -2.5237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6771 0.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9907 -0.6771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6771 -0.9907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0428 2.8615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2719 4.3850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7058 3.2164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2582 -1.6518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9056 2.6449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4964 3.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8130 -1.0824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2222 -1.8425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8393 -3.6055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 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 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 23 35 1 0 0 0 0 M END