1 Number of Atoms and Title : 2 600 Formamide (100 AMOEBA Molecules in 18.778 Ang Box) 3 Periodic Box Dimensions : 4 0.1877800000000000D+02 0.1877800000000000D+02 0.1877800000000000D+02 5 0.9000000000000000D+02 0.9000000000000000D+02 0.9000000000000000D+02 6 Current Atomic Positions : 7 -0.4758803376022480D+01 0.3860113270138316D+00 -0.2933598651562078D+01 8 -0.3664877878496234D+01 0.6999312196445734D+00 -0.2862796117887776D+01 9 -0.5272179436332538D+01 -0.3827768045237528D+00 -0.2097397697144851D+01 10 -0.5371782621202740D+01 0.9110682192531375D+00 -0.3971424527014916D+01 11 -0.6244964166015631D+01 0.4645092677245228D+00 -0.4292563994837518D+01 12 -0.4828215189915896D+01 0.1349684350152543D+01 -0.4683716475819478D+01 13 -0.6866284323513693D+01 -0.4100639383506091D+01 -0.4078653468390539D+01 14 -0.6199217960668673D+01 -0.4984573747008047D+01 -0.4319548782405161D+01 15 -0.7517694737473922D+01 -0.3445475509465532D+01 -0.4951920663263413D+01 16 -0.6765796115193224D+01 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