MMs02358657 MOE2007 2D CORINA 3.40 0006 02.08.2006 20 19 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 0.7611 -1.2926 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4389 -1.2926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2611 -1.2797 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4611 -1.2797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4777 -2.6108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7834 -3.8905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1923 -4.9349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9833 -3.8803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4999 -0.0129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1088 1.0212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1241 0.4201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2185 1.1799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 1.3183 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0222 -2.5723 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4311 -3.6166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2221 -2.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 13 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 2 0 0 0 0 6 17 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 12 1 0 0 0 0 13 14 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 17 -1 M END