MMs02623918 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 0.7474 1.3005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0051 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7423 3.8986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0102 5.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5102 5.1932 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2577 3.8927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5051 2.5951 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7577 3.8897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5051 2.5892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7372 6.4967 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2372 6.4996 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2343 7.9996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2402 4.9996 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7372 6.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4898 5.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9898 5.2079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7372 6.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9847 7.8060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4847 7.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2372 6.5114 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9847 7.8119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2321 9.1095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.4847 7.8149 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2321 9.1154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4795 10.4129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7321 9.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6114 10.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0389 9.8729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3364 10.6254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6370 9.8780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6399 8.3780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3423 7.6254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0418 8.3729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6162 7.9065 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.1451 11.7592 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -1.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0404 -0.5980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9423 3.9009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5455 3.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1031 1.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4647 1.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1352 7.5347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8918 4.1646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5918 4.1699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5826 8.8464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8826 8.8411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8393 5.4733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0867 6.7768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3341 11.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6750 10.4800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.6803 7.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3447 6.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 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 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 49 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 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 35 1 0 0 0 0 28 29 1 0 0 0 0 28 36 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 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 35 1 0 0 0 0 M END