MMs01175598 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 1.4926 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3678 1.0693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8604 0.9205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4778 -0.4466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6026 -1.6648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1100 -1.5159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9704 -0.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7273 -1.8905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1928 -1.5708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3417 -0.0783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9681 0.5246 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6367 0.6786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9397 -0.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9477 -1.5644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2348 0.6924 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1955 1.2924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2268 2.1924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5378 -0.0507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8328 0.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8248 2.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1358 -0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1438 -1.5368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4468 -2.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7418 -1.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7338 -0.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4308 0.7200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4229 2.2200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7179 2.9769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1191 1.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1941 0.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1191 -1.1941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8739 2.1630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5606 1.8950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0965 -2.7584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4098 -2.4905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6303 1.8786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4268 2.1988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2204 3.3924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0268 2.1860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5441 -1.2506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1077 -2.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4531 -3.4799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7842 -2.1175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7699 0.5825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3234 1.9409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7539 3.5824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1124 4.0129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 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 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 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 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 29 48 1 0 0 0 0 M END