MMs01697472 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 38 0 0 0 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 0.7554 -1.2959 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -1.2896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0108 -2.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5108 -2.5793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2662 -3.8752 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7662 -3.8689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 -5.0787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0776 -4.6092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0713 -3.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6428 -2.6517 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.2948 -5.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6625 -4.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8131 -3.3776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8797 -5.7466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2475 -5.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2663 -3.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0217 -5.1836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7663 -3.8939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0108 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4891 -2.6043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0217 -5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0367 0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6043 1.0367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0367 -0.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1065 -1.5375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 -4.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0392 -2.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4351 -6.3230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9700 -6.4779 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7402 -6.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3417 -4.6381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7548 -4.0366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -4.6005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -6.2378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0634 -5.7918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 2 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 M END