MMs03836582 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 58 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 1.2992 -0.7497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8973 -0.7492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 0.0010 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1962 -1.1990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1959 1.5010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8967 2.2508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4953 -0.7487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0015 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0934 -0.7482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0937 -2.2482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0020 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3531 0.6020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6915 -0.7477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6918 -2.2477 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 12.9910 -2.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9913 -4.4975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2904 -5.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5893 -4.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5890 -2.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2899 -2.2472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8885 -5.2467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8888 -6.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 1.5020 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6909 2.2523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 1.5025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6906 3.7523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5998 1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0393 0.5998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5998 -1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -1.6692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0707 -1.6689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8266 0.9196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9837 0.4602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1261 -1.6686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6688 -1.6683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3777 1.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6061 2.6287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4965 3.2901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8573 2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5968 1.7311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7242 -1.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2669 -1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 1.2015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1017 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8733 -0.9559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9521 -5.0977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2907 -6.4472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6282 -2.3968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2896 -1.0472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6888 -6.7470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8890 -7.9467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0888 -6.7465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3527 2.1018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8906 3.7525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6904 4.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4906 3.7520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 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 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 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 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 M END