MMs00027950 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 -0.0004 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2985 2.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5977 1.5006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2992 -0.7497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8966 2.2509 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6469 0.9521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1463 3.5498 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1954 3.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4947 2.2516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4950 0.7516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7935 3.0019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0927 2.2522 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0927 3.4522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0931 0.7522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6912 0.7528 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6908 2.2528 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.6908 3.4528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3916 3.0025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9897 3.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9893 4.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2889 2.2534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2892 0.7534 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.2892 -0.4466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 0.0031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9907 -1.4969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5885 0.0037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8873 0.7541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8870 2.2541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1858 3.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4850 2.2547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4854 0.7547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7839 3.0050 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0391 -0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0397 2.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2982 3.4503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6375 -0.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2995 -1.9497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4239 3.9203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9666 3.9207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7932 4.2019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9113 0.9603 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6829 -0.3755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6212 -0.9169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1639 -0.9166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 3.9216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1627 3.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3280 2.8537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8173 -0.9157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3600 -0.9153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8476 2.8538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1855 4.2044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.5248 0.1549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1868 -1.1956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 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 25 29 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 34 2 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 M END