in reply to Redone DB split help needed
HEADER 2057 CUBOOCTAHEDRAL BINARY AuCu CLUSTER COMPND 2057 AUTHOR GENERATED BY DL_POLY2 v2.13 TIMESTEP 1000 2057 0 0 0.005000 ATOM 1 Cu UNK A 1 -0.111 -0.030 0.175 1.00 0.00 Cu ATOM 2 Cu UNK A 1 -0.095 -2.146 1.879 1.00 0.00 Cu ATOM 3 Cu UNK A 1 -2.010 -0.093 2.109 1.00 0.00 Cu ATOM 4 Cu UNK A 1 -0.095 -1.910 -1.917 1.00 0.00 Cu ATOM 5 Cu UNK A 1 1.852 1.831 0.256 1.00 0.00 Cu ATOM 6 Cu UNK A 1 -1.907 2.038 0.122 1.00 0.00 Cu ATOM 7 Cu UNK A 1 0.016 -0.142 3.791 1.00 0.00 Cuthis is a bit of what i am going to be reading through and this is broken i am just not on my reg comp so i aint loged in
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