MMs01314282 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 0.0104 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3146 2.2409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6084 1.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2938 -0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9126 2.2229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9231 3.7229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6293 4.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6397 5.9818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6501 7.4818 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2064 1.4639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5107 2.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8045 1.4459 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.1087 2.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4747 1.5672 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4861 2.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9861 2.6645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7451 3.9583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0041 5.2625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5042 5.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7452 3.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2758 3.6775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2451 3.9479 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.2346 2.4479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2555 5.4479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7450 3.9375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 17.5040 5.2313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7631 6.5355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5221 7.8293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0220 7.8189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7630 6.5147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0040 5.2209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7810 9.1127 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 -0.5928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0246 2.1072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 3.4409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6331 -0.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2855 -1.9590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1033 3.5063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3413 4.8476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 3.3571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 4.6984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7457 3.1294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2884 3.1187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5789 1.6212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6113 6.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9114 6.3163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3378 2.8941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5631 6.5438 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9293 8.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.9630 6.5064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5968 4.1775 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 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 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 3 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 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 47 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 21 22 2 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 53 1 0 0 0 0 34 54 1 0 0 0 0 M END