MMs00707728 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7474 -1.3005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2474 -1.3035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2474 -1.3094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4949 -2.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9949 -2.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4964 -3.7236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2446 -4.8969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8679 -3.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7140 -1.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8307 -0.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2564 -1.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3731 -0.0875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7988 -0.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1077 -2.0216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9154 0.4477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6065 1.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7232 2.9170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1488 2.4507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4578 0.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3411 -0.0186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2655 3.4522 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 17.6912 2.9859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9565 4.9200 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0404 0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 1.0345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 1.0292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3928 -3.6420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9059 -3.7183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8866 0.1180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3962 0.4358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6909 -2.1474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2006 -1.8296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1259 1.0868 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4659 2.2886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4760 4.0913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5983 0.6098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5883 -1.1929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END