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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 0.35106 55 15 0.8245175 -0.07836975 0.5603829 -0.1941326 0.8910697 0.4102528 -0.5314917 -0.4470492 0.7194885 -0.1793 0.0060621 -55.013
seed 0
mol 1
atom 1 - O ** - -0.2208843 -0.4392539 0.2340714 3.127068 1 9 s
atom 2 - O ** - -0.6041527 -1.303609 0.6001022 -3.143334 1 5 d
atom 3 - O ** - -0.603581 0.4976663 -0.5078529 -3.094116 1 5 d
atom 4 - N ** - 0.09497213 1.608132 -1.153839 1.835686 1 6 s
atom 5 - N ** - 1.309989 -0.4044079 0.07004232 -2.517964 3 2 d 3 d 7 s
atom 6 - C ** - -0.1269484 0.6327909 -0.4094253 1.104795 3 4 s 8 s 9 d
atom 7 - C ** - -0.4175839 -0.4115197 0.1304404 -1.024655 3 5 s 8 d 10 s
atom 8 - C ** - -0.0355916 0.6437205 -0.431094 -0.2934717 2 6 s 7 d
atom 9 - C ** - 0.1193404 -0.4583416 0.2144874 1.762807 3 1 s 6 d 11 s
atom 10 - C ** - -0.0001354218 -1.484183 0.7339469 -0.3611132 2 7 s 11 d
atom 11 - C ** - -0.1949205 -1.506575 0.7759678 1.024741 2 9 s 10 d
endmol 1