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© September 2007; August 2010 Lorentz JÄNTSCHI && Sorana Daniela BOLBOACĂ

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forcefield mm+
sys 0 0 1
view 40 0.26536 55 15 0.7545812 -0.1140093 0.6462269 -0.2070177 0.8931425 0.3992997 -0.6226965 -0.4350844 0.6503465 0.098693 0.5117 -54.971
seed 0
mol 1
atom 1 - O ** - -0.5980282 1.306296 -0.7870727 -3.106695 1 5 d
atom 2 - O ** - -0.5912714 -1.819133 1.07499 2.987133 1 6 d
atom 3 - O ** - -0.5858808 2.360751 -1.447926 -1.408034 1 5 d
atom 4 - O ** - -0.5880604 -0.05742079 -0.05561131 3.259619 1 6 d
atom 5 - N ** - 1.308976 1.399599 -0.8978108 -1.899675 3 1 d 3 d 8 s
atom 6 - N ** - 1.311511 -0.887112 0.4457394 2.527853 3 2 d 4 d 9 s
atom 7 - C ** - 0.1692445 0.2740891 -0.3595596 0.3670345 3 8 d 9 s 10 s
atom 8 - C ** - -0.4460459 0.2962011 -0.3208137 -1.04634 3 5 s 7 d 11 s
atom 9 - C ** - -0.4454393 -0.7792495 0.3115526 1.030631 3 6 s 7 s 12 d
atom 10 - C ** - -0.1746411 1.311863 -1.105953 1.124469 1 7 s
atom 11 - C ** - 0.04210997 -0.7465158 0.295764 -1.753826 2 8 s 13 d
atom 12 - C ** - 0.04062748 -1.808285 0.9212148 0.2973628 2 9 d 13 s
atom 13 - C ** - -0.1558795 -1.799061 0.8983464 -1.085943 2 11 d 12 s
endmol 1