element(s):
['C', 'O']
AFLOW prototype label:
AB_cP8_198_a_a
Parameter names:
['a', 'x1', 'x2']
model type (only 'standard' supported at this time):
standard
number of parameter sets:
1
Parameter values for parameter set 0:
['5.6402', '0.45400088', '0.57106038']
model name:
Sim_LAMMPS_IFF_PCFF_HeinzMishraLinEmami_2015Ver1v5_FccmetalsMineralsSolventsPolymers__SM_039297821658_000
==== Building ASE atoms object with: ====
representative atom symbols =  ['C', 'O']
representative atom coordinates =  [[0.45400088 0.45400088 0.45400088]
 [0.57106038 0.57106038 0.57106038]]
spacegroup =  198
cell =  [[5.6402, 0, 0], [0, 5.6402, 0], [0, 0, 5.6402]]
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