MMs00193178 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 1.4749 -0.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4489 0.8678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9238 0.5948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4248 -0.8191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4509 -1.9599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9760 -1.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8998 -1.0921 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8737 0.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3486 -0.2243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4365 0.8085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7549 0.0930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4818 -1.3819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3080 -2.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9947 -1.5780 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1086 0.7391 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3450 -0.1102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6987 0.5358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8161 2.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9351 -0.3135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.2888 0.3326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5252 -0.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8789 0.1293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9963 1.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7599 2.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4062 1.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3500 2.2708 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2184 1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 0.2184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2184 -1.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 1.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7029 1.5074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8517 -3.0910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1968 -2.5995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3006 -2.2232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8396 0.6575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2937 1.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5041 -0.9663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0420 -1.0870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8412 -1.5098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4313 -1.7131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8680 -0.5501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8538 3.6704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4171 2.5075 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 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 40 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 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 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