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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 0.31689 55 15 0.7060801 -0.1185682 0.698135 -0.1920877 0.9168485 0.3499874 -0.6815814 -0.3812223 0.624593 0.029338 0.057073 -54.649
seed 0
mol 1
atom 1 - O ** - -0.5894547 1.033127 0.1175905 2.580672 1 3 d
atom 2 - O ** - -0.6171818 -1.02343 -0.3888236 2.580752 1 3 d
atom 3 - N ** - 1.313933 -0.0002808644 -0.1017109 1.98307 3 1 d 2 d 6 s
atom 4 - N ** - 0.07958317 -2.052139 1.399915 0.3989705 1 7 s
atom 5 - N ** - 0.07934189 2.05734 -1.412397 -2.287086 1 8 s
atom 6 - C ** - -0.4209118 -0.01905086 -0.03059843 0.4912227 3 3 s 7 d 9 s
atom 7 - C ** - -0.005042553 -1.058265 0.596464 -0.2212584 3 4 s 6 d 10 s
atom 8 - C ** - -0.1265531 1.073184 -0.6402691 -1.591312 3 5 s 9 d 11 s
atom 9 - C ** - -0.04265833 1.046298 -0.630864 -0.19816 2 6 s 8 d
atom 10 - C ** - -0.1405272 -1.016418 0.5741029 -1.63231 2 7 s 11 d
atom 11 - C ** - -0.05637169 0.03302769 -0.01498127 -2.305707 2 8 s 10 d
endmol 1