MMs00098851 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 0.7538 -1.2968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0076 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2538 -1.2924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2538 -1.2836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5076 -2.5849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7538 -1.2792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9681 -0.2856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1293 -1.7769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7607 -2.3910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5147 -3.5655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4305 -2.5231 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7462 1.3188 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2462 1.3144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4924 2.6113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4924 2.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9923 2.6244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7385 3.9257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7462 1.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0375 -0.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4462 -1.2968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0334 -2.0011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5893 -3.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0486 -3.1950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0489 -2.4748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3826 -1.6996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8712 0.4159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2049 1.1912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4340 -3.7231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3635 3.0272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6973 3.8024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1923 2.6244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7795 3.3287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3355 4.9667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6976 4.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7087 0.7246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3492 0.2901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7836 1.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 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 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 17 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 M END