MMs00031310 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 -0.0051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2544 1.2914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7544 1.2863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5088 2.5828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7632 3.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2632 3.8895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5088 2.5930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5176 5.1910 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0176 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0088 2.5777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7544 1.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 -0.0203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2544 1.2711 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0305 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5999 1.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3852 -1.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4965 -2.4062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7981 -1.6606 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7981 -2.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4912 -0.1924 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.8018 0.9667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7928 0.5532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9041 -0.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2893 -1.8225 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 13.4484 -1.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0349 -3.1241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5349 -3.1292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2893 -1.8327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2805 -4.4307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7805 -4.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5349 -3.1393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0349 -3.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7805 -4.4460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0261 -5.7425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5261 -5.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0041 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0041 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3509 0.2451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3667 4.9216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3088 2.5970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0217 6.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1824 5.2002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0136 3.9961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6123 3.6149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8579 2.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3480 -0.7952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6766 -2.3672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6127 0.5142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9413 -1.0578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6770 -5.4679 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9384 -2.0981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6384 -2.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9805 -4.4501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.6225 -6.7837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9226 -6.7746 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 46 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 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 52 1 0 0 0 0 31 32 1 0 0 0 0 31 36 2 0 0 0 0 32 33 2 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 35 2 0 0 0 0 34 55 1 0 0 0 0 35 36 1 0 0 0 0 35 56 1 0 0 0 0 36 57 1 0 0 0 0 M END