MMs01453022 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 41 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 1.4928 0.1466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 1.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3662 -1.0729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8590 -0.9263 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6179 0.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0171 1.7421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0829 0.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2044 1.0419 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2295 -1.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8551 -2.0478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5332 -3.5129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5234 -2.2059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8276 -1.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8378 0.0352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1215 -2.2236 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4256 -1.4824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4358 0.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7399 0.7586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0338 -0.0002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0236 -1.5002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7195 -2.2413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7092 -3.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6990 -5.2412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7501 2.2586 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1173 1.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1943 -0.1173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1173 -1.1943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8928 1.1859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2051 1.0172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6078 2.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0193 2.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2841 -1.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6891 -2.2286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7458 -3.1198 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2885 -3.1304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1133 -3.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4007 0.6246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0771 0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0587 -2.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 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 8 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 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 24 3 0 0 0 0 M END