MMs01260799 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 46 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 1.5000 -0.0106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2592 1.2831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2407 -1.3150 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7407 -1.3256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4999 -0.0319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9998 -0.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7406 -1.3469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9814 -2.6406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4815 -2.6299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2406 -1.3575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9998 -0.0638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9814 -2.6618 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4813 -2.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2221 -3.9768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7220 -3.9874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4812 -2.6937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7405 -1.3894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2405 -1.3788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9812 -2.7044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8715 -1.4971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2947 -1.9707 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7246 -1.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5976 -2.7371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7074 -3.9443 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 17.2841 -3.4707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8543 -3.9241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0085 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0085 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6334 -2.3499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9073 1.0116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6072 0.9924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5740 -3.6840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8741 -3.6649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -3.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6147 -5.0117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3147 -5.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3478 -0.3545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6479 -0.3353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5087 -0.3532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.1035 -0.3787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.7976 -2.7456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 27 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 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 1 0 0 0 0 26 27 2 0 0 0 0 M END