MMs02072986 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.4550 0.3645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8668 1.8069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3219 2.1714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3651 1.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9533 -0.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4982 -0.7133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8201 1.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9703 0.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2415 1.2916 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7379 1.1887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2982 2.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1481 3.5429 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8769 2.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3805 2.8496 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5342 -0.0825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0333 -0.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7360 1.2968 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8296 -1.2996 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3286 -1.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0313 0.0796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5303 0.1337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3267 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6240 -2.4627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1249 -2.5168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4222 -3.8420 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2916 1.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -0.2916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2916 -1.1640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0323 2.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6513 3.3253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7878 -1.2110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1688 -1.8672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8879 -0.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4623 2.8717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4221 -0.5333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7851 -1.2560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2674 -2.3598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3943 1.0966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0925 1.1939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5259 -1.0942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2610 -3.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 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 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 15 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 M END