MMs00245943 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 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 -0.7458 -1.3014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0083 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2458 -1.3063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2458 -1.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4916 -2.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9916 -2.6077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7458 -1.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6236 -2.5371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0516 -2.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0565 -0.5781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6314 -0.1100 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.2623 -2.9637 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.2231 -3.5637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1007 -4.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3114 -5.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6837 -4.7349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8453 -3.2436 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.6346 -2.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2175 -2.6379 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -14.8232 -4.0102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.6118 -1.2656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.5898 -2.0322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7514 -0.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1237 0.0648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3344 -0.8208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1728 -2.3121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.8005 -2.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3835 -3.1976 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0412 -0.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5967 1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 0.5967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4542 -1.3014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0289 -3.2014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6117 -3.6354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0456 -1.9947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4033 1.0315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1033 1.0228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0883 -3.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3883 -3.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9483 -4.1205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5712 -5.5318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4455 -6.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9792 -6.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9703 -5.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8810 -4.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9668 -1.3610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5005 -1.5272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7829 0.1675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.2529 1.2578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.4322 -0.3362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6712 -4.1108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 30 54 1 0 0 0 0 M END