MMs01493668 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.5000 -0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2546 1.2911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7545 1.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7454 -1.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2454 -1.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0211 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7454 -1.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9908 -2.6192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2454 -1.3281 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6454 -0.2888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9908 -2.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2362 -3.9261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9817 -5.2278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4817 -5.2331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2362 -3.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4908 -2.6350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2454 -1.3386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2545 1.2594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6492 2.6319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7675 3.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0639 2.8771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7468 1.4110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4363 3.4824 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0042 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0042 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6582 2.3324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3582 2.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3417 -2.3536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6418 -2.3441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6036 1.0160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0362 -3.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3780 -6.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0780 -6.2744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4362 -3.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7926 -2.1165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4763 2.8855 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6462 4.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 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 13 1 0 0 0 0 11 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END