MMs02445584 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 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 0.7501 -1.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2501 -1.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0002 -2.5979 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2503 -3.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0004 -5.1959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7503 -3.8971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1504 -4.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0002 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4998 -2.5982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5002 -2.5978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1896 -1.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3820 -3.8112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8085 -3.3476 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8085 -4.5476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8084 -1.8476 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8084 -0.6476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3818 -1.3842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0219 -0.9658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3922 -1.5758 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6057 -0.6941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4488 0.7977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9760 -1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1895 -0.4223 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5599 -1.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7168 -2.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0871 -3.1341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3006 -2.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1437 -0.7606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7733 -0.1506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6710 -2.8623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8844 -1.9806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7275 -0.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9410 0.3930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3113 -0.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4682 -1.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2548 -2.5906 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0221 -4.2292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0392 0.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6001 1.0392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0392 -0.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 -0.2596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3428 -4.4113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8701 -4.9074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1586 -0.1323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6928 0.0291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3051 -2.2990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8393 -2.1376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7460 -3.2295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2126 -4.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1145 -0.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6478 1.0429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6312 -0.0008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.8155 1.5864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2821 0.4884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.5645 -2.1968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.3803 -3.7840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8967 -5.4226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 9 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 21 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 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 53 1 0 0 0 0 34 35 1 0 0 0 0 34 54 1 0 0 0 0 35 36 2 0 0 0 0 35 55 1 0 0 0 0 36 37 1 0 0 0 0 36 56 1 0 0 0 0 37 57 1 0 0 0 0 38 58 1 0 0 0 0 M END