MMs02594514 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 35 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 0.6648 -1.3446 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0323 -2.6728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0154 -3.7462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 -3.0815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -1.5972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2168 -0.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6609 -0.9552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1814 -2.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3493 -3.6100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6802 -2.3016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0859 -0.8575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8379 -0.0254 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4927 -0.3369 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6469 -1.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3944 -2.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5486 -3.7315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9554 -3.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2079 -1.7324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0537 -0.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6147 -1.2118 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0757 0.5318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5318 1.0757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0757 -0.5318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2197 -2.8462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8134 -4.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4226 -3.6391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9202 0.6133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6948 0.8460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2690 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3465 -4.9144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8787 -3.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2557 0.4085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 33 1 0 0 0 0 M END