MMs00245731 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 -0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2548 1.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7548 1.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7452 -1.3128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2452 -1.3073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4904 -2.6036 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0221 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9944 -1.5221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0055 1.4779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 -0.0276 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2452 -1.3294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7452 -1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7547 1.2631 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.9547 1.2631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2547 1.2687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5095 2.5594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0018 2.7107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3191 4.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0228 4.9316 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9044 3.9320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6917 4.7818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9019 3.8957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2745 4.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4368 5.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2265 6.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8539 6.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8093 6.5970 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0044 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0044 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6586 2.3322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3586 2.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3414 -2.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1160 -1.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4492 -2.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5324 -2.5159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8713 -1.7495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4163 -0.8134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4220 0.7293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1286 1.6832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4675 2.4497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7721 2.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2427 3.7918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3563 8.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8857 6.9819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 29 48 1 0 0 0 0 M END