MMs00688333 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.3043 -0.7408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5874 1.5183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8812 2.2774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1855 1.5366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9023 -0.7225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5003 -0.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5109 -2.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 0.0549 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0983 -0.6859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1089 -2.1858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4132 -2.9267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7069 -2.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6963 -0.6676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 0.0733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9901 0.0916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3646 -0.5089 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3605 0.6129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8604 0.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6012 1.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8421 3.2215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3421 3.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6013 1.9066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1363 1.5844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.1012 1.9383 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5927 1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 0.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5927 -1.0434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 2.1109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8727 3.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2204 2.1439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9108 -1.9225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7856 1.2549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0739 -2.7932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4217 -4.1266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7503 -2.7602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3836 1.2732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4677 -0.4115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4348 4.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7348 4.2459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 M END