File: atoms_info_copy.py

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python-ase 3.12.0-2
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from ase import Atoms

at1 = Atoms('H2', positions=[[0., 0., 0.],
                             [1., 0., 0.]])

at1.info['str'] = "str"
at1.info['int'] = 42

at2 = Atoms(at1)

assert at2.info == at1.info