MMs01160516 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 51 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 -1.5000 0.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2487 1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4973 2.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7513 1.2983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7487 1.3029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4973 2.6027 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9973 2.6042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7487 1.3059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7460 3.9040 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.5869 4.2146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1345 5.2737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2482 6.2785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5480 5.5299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2376 4.0623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.2425 2.9486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7341 3.1070 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.3456 1.7373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2319 0.7324 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9321 1.4811 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -12.8131 1.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2781 0.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7457 -0.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2106 -1.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2081 -2.8514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7405 -2.5411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2756 -1.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6731 -4.2776 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5989 -1.0398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1011 -1.0371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0963 3.6395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9513 1.2970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5415 0.1209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8767 0.8936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8963 3.6413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0959 4.6726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4282 6.2438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3556 7.0806 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9526 7.2501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0350 6.6266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6897 5.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8538 2.6262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0013 1.5951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.5477 0.5830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3847 -1.9840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9385 -3.4337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1015 -0.8667 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 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 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 M END