MMs00041288 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 61 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 -0.7487 1.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0025 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5025 2.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2513 1.2969 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 3.7513 1.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5025 2.5937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0025 2.5923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7513 1.2925 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0044 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7487 -1.3056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2487 -1.3070 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6487 -2.3463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1316 -0.0944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5577 -0.5593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5563 -2.0593 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.5955 -1.4593 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1292 -2.5214 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.2807 -3.3699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1278 -4.0214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5539 -4.4863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4368 -3.2736 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7474 -4.4328 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9368 -3.2751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6855 -4.5749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9343 -5.8732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1855 -4.5763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9368 -3.2780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4368 -3.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1855 -4.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4343 -5.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9343 -5.8761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4369 -6.9932 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8078 -6.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6524 -4.8925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7462 3.8978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 5.1976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -1.0386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9487 1.3009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1035 3.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -1.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 3.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6035 3.6309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1477 -2.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0929 0.5066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6207 1.0014 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0648 -5.5821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5926 -5.0873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5378 -2.2364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3378 -2.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0378 -2.2408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3332 -6.9147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1775 -7.5261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9818 -6.1361 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 40 1 0 0 0 0 2 3 2 0 0 0 0 2 41 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 37 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 54 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 38 39 3 0 0 0 0 M END