MMs00674939 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 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 -0.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2467 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7467 -1.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7533 1.2895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 1.2933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5066 2.5866 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7533 1.2819 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7467 -1.3162 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2467 -1.3200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0228 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9934 -2.6209 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4934 -2.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2467 -1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7467 -1.3314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4934 -2.6323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7401 -3.9295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2401 -3.9257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4868 -5.2228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0000 -0.0381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6441 -2.3424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3441 -2.3493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6559 2.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1440 -2.3539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3907 -3.6586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6493 -0.2868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6934 -2.6354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3374 -4.9702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4491 -4.6201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8841 -6.2605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5245 -5.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7533 1.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3559 2.3044 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 38 39 1 0 0 0 0 M END