MMs02605451 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 55 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 1.3016 -0.7456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3066 -2.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6082 -2.9912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9047 -2.2369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8996 -0.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4977 -0.7281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7891 1.5263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0957 -0.7193 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3872 1.5350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3459 2.1315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6837 2.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6786 3.7894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9853 1.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 0.0438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6938 -0.7106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4184 -0.4149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2960 0.8016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4103 2.0121 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8868 -1.8399 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.7353 -0.9914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3149 -2.2987 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 17.4740 -2.6092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3200 -3.7986 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 16.3200 -4.9986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8950 -4.2670 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.7358 -4.5776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0092 -3.0564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4362 -5.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4437 -6.8064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5365 -4.6762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5255 -1.4129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5965 1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0412 0.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2694 -2.8491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6122 -4.1912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9459 -2.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5940 1.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7294 -1.6499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2721 -1.6447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0998 -1.9193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4960 0.8056 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3748 -5.1353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7006 -6.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0767 -7.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6311 -4.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6234 -1.8973 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 9 45 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 20 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 36 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 48 1 0 0 0 0 33 49 1 0 0 0 0 34 50 1 0 0 0 0 35 51 1 0 0 0 0 36 52 1 0 0 0 0 M END