MMs01645474 MOE2007 2D CORINA 3.40 0006 02.08.2006 38 40 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 -0.7597 1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2596 1.2822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2403 -1.3158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7403 -1.3046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2595 1.2599 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7524 1.4056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0752 2.8705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7818 3.6301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6596 2.6347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7478 0.2834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2173 0.5844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6914 2.0075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2127 -0.5378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6822 -0.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1563 1.1862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6258 1.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6212 0.3650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1470 -1.0581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6775 -1.3590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1424 -2.1802 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -16.0907 0.6659 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1674 2.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8673 2.3170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8325 -2.3594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1326 -2.3393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2827 -1.2137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6244 -0.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1751 3.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6653 4.8244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3685 -0.8550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8334 -1.6763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3600 2.0840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0051 2.6256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2982 -2.4975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 12 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 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 M END