MMs03197697 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 42 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 1.2955 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0121 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8541 1.2904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -1.3147 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9006 0.7318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1891 -1.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4846 -2.2803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7871 -1.5364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4986 0.7196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0967 0.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3852 -1.5486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6807 -2.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6737 -3.8046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9692 -4.5607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6947 0.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7017 2.1953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0043 2.9392 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.4062 2.9514 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6049 1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 0.6049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 -1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5199 -1.6717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0626 -1.6789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1471 -2.1194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4790 -3.4803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8235 -2.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5042 1.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3296 1.6303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8723 1.6231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2044 -1.3347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9695 -2.6743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0964 -1.1789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8615 -2.5185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3644 -5.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0056 -5.1655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5741 -3.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7017 3.3953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 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 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 M END