MMs02953249 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 0.7511 -1.2984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2511 -1.2971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0022 -2.5956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5022 -2.5943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2511 -1.2946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7511 -1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6338 -2.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0600 -2.0414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0587 -0.5414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6317 -0.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1670 1.3471 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2742 -2.9221 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.3936 -4.1364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1549 -1.7078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4885 -3.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3330 -5.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5472 -6.1753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9170 -5.5641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0726 -4.0722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8583 -3.1915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4424 -3.4609 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 15.1313 -6.4447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9758 -7.9366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0387 0.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6009 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 -0.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4031 -3.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1031 -3.6330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0991 1.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3991 1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2639 -3.6477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9692 2.2395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9930 1.5956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2371 -5.7837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4228 -7.3689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9827 -1.9980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7822 -7.8122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8513 -9.1302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1693 -8.0611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 39 1 0 0 0 0 25 26 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 M END