MMs00679944 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7581 -1.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0163 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7744 -3.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2744 -3.8829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0162 -2.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2581 -1.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 0.0188 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2418 1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 0.0282 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4837 -2.6074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2418 -1.3131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2255 -3.9111 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7255 -3.9205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4836 -2.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9836 -2.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7255 -3.9393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9673 -5.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4674 -5.2242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7092 -6.5185 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.7417 -1.3413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2345 -1.1938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5555 0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2612 1.0295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1402 0.0328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2706 2.5295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5743 3.2713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8686 2.5132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8592 1.0133 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0355 -0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6065 1.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0355 0.6065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1809 -4.9353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8809 -4.9184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2162 -2.5717 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6191 -4.9466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8902 -1.5832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9254 -3.9468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5608 -6.2766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2351 3.1360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5818 4.4713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9116 3.1067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 29 2 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 26 27 1 0 0 0 0 26 40 1 0 0 0 0 27 28 2 0 0 0 0 27 41 1 0 0 0 0 28 29 1 0 0 0 0 28 42 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END