MMs01628708 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.3039 -0.7416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3136 -2.2415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0169 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8396 1.3110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3564 -1.2773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8922 0.7753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8824 2.2752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1766 3.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4805 2.2921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4902 0.7921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8038 -1.4494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0882 0.8090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3921 0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6862 0.8259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6765 2.3258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9706 3.0842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2745 2.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2843 0.8427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9998 -1.4157 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.7746 3.0505 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0431 0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5932 -1.0431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1136 -2.2493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3214 -3.4415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5136 -2.2337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8393 2.8685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1688 4.2336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2038 -1.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0804 2.0090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6267 -0.8568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1694 -0.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6334 2.9191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9628 4.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3098 2.9494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3274 0.2495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 6 2 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 M END