MMs03822062 MOE2007 2D CORINA 3.40 0006 02.08.2006 51 51 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 1.5000 -0.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 1.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -1.3024 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0480 -1.3024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -1.3047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0068 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4961 -2.6049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9961 -2.6071 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3961 -3.6464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 -1.3092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2480 -1.3115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9961 -2.6117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2441 -3.9096 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.4441 -3.9096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 -3.9073 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3441 -4.9465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9922 -5.2052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5906 -6.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9921 -5.2097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1921 -5.2115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -0.0136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2520 1.2866 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5000 -0.0158 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2519 1.2821 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8519 2.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5039 2.5822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7519 1.2798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5039 2.5777 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 -0.0204 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8984 -1.0587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7000 -0.0222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0018 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0018 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 1.0370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2903 0.6941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8535 2.3340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2136 1.8972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8945 -3.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1496 -0.2691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9165 -1.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9142 -3.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0984 -1.0560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5440 3.1807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9055 3.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4638 1.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4961 -2.6003 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4578 -1.9988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8945 -3.6387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5344 -3.2019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 48 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 2 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 48 51 1 0 0 0 0 M CHG 1 48 1 M END