MMs03618385 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 -0.7440 1.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 1.3094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 0.0138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -1.2887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -1.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 1.3232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7440 1.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4999 0.0345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9999 0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7439 1.3439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9880 2.6395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4880 2.6326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7320 3.9281 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 -11.2439 1.3508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9999 0.0552 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2559 -1.2473 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.0118 -2.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2678 -3.8453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5118 -2.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2558 -1.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7558 -1.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5118 -2.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7678 -3.8246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2678 -3.8315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1392 2.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8392 2.3514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8607 -2.3251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1608 -2.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -1.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6295 -0.3845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9047 -1.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6047 -0.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5832 3.6814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8391 2.3928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0559 -1.2528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6511 -0.1970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3510 -0.1846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.7118 -2.5166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6726 -4.8735 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 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 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 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 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 M END