MMs00028454 MOE2007 2D CORINA 3.40 0006 02.08.2006 61 64 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 1.2986 -0.7508 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 1.4984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 -0.7524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8957 -2.2524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1943 -3.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4938 -2.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4947 -0.7540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0928 -0.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0919 -2.2556 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6909 -0.7572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6909 0.4428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8467 -2.2491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3138 -2.5619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0646 -1.2633 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.6646 -2.3025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0616 -0.1480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.7510 1.0112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8124 1.1506 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2794 0.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4353 -0.6540 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.2838 0.1945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7338 -1.4048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0334 -0.6556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0343 0.8444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.3319 -1.4064 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6314 -0.6572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6324 0.8428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9319 1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2304 0.8412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2295 -0.6588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9300 -1.4080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6006 1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0389 0.6006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6006 -1.0389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8561 -2.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1936 -4.2032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5327 -2.8546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1969 1.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7950 1.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3930 1.1936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6468 -2.2484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7206 -3.4424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4056 2.0312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4794 0.8371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3312 -2.6064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6314 -1.8572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.4505 0.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2226 1.9706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1611 2.5117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.7038 2.5107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.6415 1.9685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4121 0.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 24.4114 -0.4512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.6392 -1.7867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1581 -2.3268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.7008 -2.3278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 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 45 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 46 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 36 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 35 36 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 M END