MMs01461931 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 -1.5000 0.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2469 1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4938 2.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0062 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7531 1.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7593 3.8953 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.7469 1.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6257 2.5236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0533 2.0635 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0569 0.5635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6315 0.0966 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1713 -1.3311 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.2726 -0.3153 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.6414 0.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8570 -0.5807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7038 -2.0728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2259 0.0327 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.5343 1.5007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0257 1.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6390 0.2922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5267 -0.7142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5975 -1.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1025 -1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0913 3.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9531 1.2944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9764 -2.2210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9982 -1.5834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9680 1.2914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5026 1.1338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3405 1.6233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5314 2.7007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7734 2.8342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1660 2.0346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6768 0.8947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3467 -0.6769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8237 -1.6867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4204 -1.5150 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 26 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 M END