MMs01048217 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 -0.7461 -1.3013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0078 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5078 -2.5936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2539 -1.2923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 -1.5998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8833 -3.0911 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5148 -3.7053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8337 -0.5928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2617 -1.0520 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3734 -0.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0572 1.4213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8014 -0.5043 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9131 0.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3410 0.0435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4528 1.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1365 2.5168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2482 3.5238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6762 3.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9924 1.5983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8807 0.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7879 4.0716 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.7949 2.9599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7809 5.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8996 5.0786 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6031 1.0374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9461 -1.3049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5891 -3.6391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0969 1.0455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8859 0.1432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3939 0.4685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5147 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0544 -1.6773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9653 1.2387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4733 1.5640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7809 -1.0177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2889 -0.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9941 2.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9952 4.6969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1348 1.2309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1337 -0.5817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0420 4.7112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6466 6.2517 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 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 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 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 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END