&general
startframe=1, endframe=5000, interval=100, verbose=2, keep_file=0
/
&gb
igb=5, saltcon=0.100,
ifqnt=1, qm_residues="211,249,252,281,545,546,568", qmcharge_lig=-1, qmcharge_rec=0, qmcharge_com=-1,
qm_theory="PM6"