MMs00831680 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 43 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 -0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2494 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4988 -2.5987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0012 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7506 -1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7517 -3.8968 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6003 -3.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2191 -4.2080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3765 -5.6997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0065 -6.3104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0023 -5.1962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4977 -5.1968 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6977 -5.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2483 -3.8981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2471 -6.4962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4965 -7.7949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -9.0943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7460 -9.0949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4965 -7.7962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7471 -6.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6759 -6.4491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0460 -5.8384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0501 -6.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3007 -8.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8334 -7.9408 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5995 1.0395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1005 1.0383 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4494 -1.3006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9506 -1.2982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -3.0145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4191 -4.2075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2965 -7.7944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6455 -10.1332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3455 -10.1344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3476 -5.4579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2949 -4.6645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2435 -6.8267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7893 -9.3481 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 M END