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Supporting information

cif

Crystallographic Information File (CIF)
Contains datablocks default, 1_at_300_K, 1_at_90_K

hkl

Structure factor file (CIF format)
Contains datablock (1)_at_300_K

hkl

Structure factor file (CIF format)
Contains datablock (1)_at_90_K

CCDC references: 135715; 135716

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