MMs00647963 MOE2007 2D CORINA 3.40 0006 02.08.2006 41 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 1.4471 0.3949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5126 -0.6608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1311 -2.1115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1967 -3.1672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6437 -2.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0253 -1.3216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9597 -0.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7093 -3.8280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4815 -5.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8212 -5.9854 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8769 -4.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1897 -3.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0009 -2.3248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3137 -0.9914 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4992 -2.3963 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1863 -3.7297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3752 -4.9914 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3103 -1.1346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8086 -1.2061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6197 0.0556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1180 -0.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8052 -1.3493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9940 -2.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4957 -2.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3034 -1.4208 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3159 1.1577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1577 -0.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3159 -1.1577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9735 -2.4274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8915 -4.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1829 -1.0057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2649 0.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4148 -5.8604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3850 -3.7869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2035 -0.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5748 0.0359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0700 1.1223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7669 0.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5438 -3.6777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8468 -3.5489 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 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 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 19 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END