MMs02852211 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 52 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 -0.7477 -1.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2477 -1.3030 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6477 -0.2638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9954 -2.6033 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5954 -3.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4954 -2.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2477 -1.3083 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2431 -3.9063 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7431 -3.9090 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.1431 -4.9482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4954 -2.6113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9954 -2.6139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7477 -1.3162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0000 -0.0158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7523 1.2819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2523 1.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0000 -0.0211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2477 -1.3188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4909 -5.2093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9909 -5.2120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7431 -3.8984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0403 -0.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5982 1.0403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0403 0.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3806 -1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8509 -1.8914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9618 0.5966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6018 1.0329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0382 -0.6071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6413 -4.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3685 -2.1989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7059 -1.4299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7850 -3.7953 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1223 -3.0263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3477 -2.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8000 -0.0137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1541 2.3222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4523 1.2793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2000 -0.0232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8459 -2.3591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4064 3.6173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -5.0984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4569 -3.8963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7442 -3.2984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0045 2.5770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.2045 2.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7386 -6.5070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2431 -3.9011 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8413 -4.9413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3367 -7.5473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 50 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 50 1 0 0 0 0 43 47 1 0 0 0 0 47 48 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END