MMs03616969 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 44 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 1.2996 0.7491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3007 2.2491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0019 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5588 -0.6019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8977 0.7472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 2.2472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0038 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4957 0.7453 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.5350 1.3453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4968 2.2453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7931 -1.5057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0938 0.7434 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0947 1.9434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0075 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.3923 1.1925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3912 -1.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6897 -2.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6886 -3.7585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6919 0.7415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6930 2.2415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2900 0.7396 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5992 1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0397 -0.5992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5992 -1.0397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2604 1.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5007 2.2482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3015 3.4491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1007 2.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1953 -1.2038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6968 2.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4977 3.4453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2968 2.2462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2096 -1.2983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9800 -2.6349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2184 -0.9281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7611 -0.9292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3288 0.1389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5573 -2.1011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9893 -1.5094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -1.5019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6358 -2.1026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0281 -2.1102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 43 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 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 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 41 43 1 0 0 0 0 42 45 1 0 0 0 0 43 44 1 0 0 0 0 M END