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lammps/regtest/bond/ref/log.none-charmm-b
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log.none-charmm-b
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Step Temp E_pair E_mol TotEng Press
0 0 0 21.145979 21.145979 400.512099
1 207.71964 0 17.885724 20.981588 617.126672
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Step Temp E_pair E_mol TotEng Press
0 207.71964 0 17.885724 20.981588 617.126672
1 673.3871 0 10.589327 20.625522 1135.764649
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Step Temp E_pair E_mol TotEng Press
1 207.71964 0 17.885724 20.981588 617.126672
2 673.3871 0 10.589327 20.625522 1135.764649
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