MMs01419946 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 -0.7523 -1.2977 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 -1.2951 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2496 0.2049 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2549 -2.7951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7523 -1.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 0.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7523 -1.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0045 -2.5876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5045 -2.5902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2523 -1.2846 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 0.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2477 1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5000 0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2477 1.3187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5229 1.9025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2356 3.0840 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.6599 3.5083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9245 2.8344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5243 2.2430 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -14.3728 1.3944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7973 0.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5588 3.4585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0219 3.7683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3421 4.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3124 2.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0557 4.9157 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.0382 -0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6018 1.0382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0382 0.6018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0448 -3.1963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5936 -3.6383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0357 -1.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8982 1.0460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5982 1.0507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6063 -3.6258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9063 -3.6305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8541 -2.3228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2937 -1.1638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6283 -0.3901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5860 1.3058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6943 1.6421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4873 3.8943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7347 1.9492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4152 -0.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8933 0.4693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1157 3.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5042 4.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3626 4.8543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8279 5.3072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4839 1.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3445 3.1871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 27 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END