MMs01317287 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 1.4746 -0.2746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4498 0.8651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9245 0.5905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8996 1.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3743 1.4556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8737 0.0412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8986 -1.0986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4239 -0.8239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3484 -0.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9930 -1.5879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4803 -1.3935 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7549 0.0812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4373 0.7981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1094 0.7258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3448 -0.1249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2258 -1.6202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1068 -3.1155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6993 0.5197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9347 -0.3310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2892 0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5246 -0.5372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8791 0.1074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9981 1.6027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7626 2.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4082 1.8088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8183 2.0149 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.2197 1.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1797 0.2197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2197 -1.1797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0534 -1.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5081 -0.8846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5001 2.8617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1544 2.3674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2981 -2.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6438 -1.7357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4194 -2.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2046 1.9220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8395 -1.5273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4294 -1.7334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8674 -0.5731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0816 2.1184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8578 3.6496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4198 2.4894 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 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 3 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 39 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 40 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 43 1 0 0 0 0 26 44 1 0 0 0 0 M END