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The number of restraints is reported as 350, but no details about these restraints were given in the _refine_special_details section of the cif file. The Ueq values of the following atoms are extremely large(Ueq = > 0.15). Either the occupancy is set too high for these atom, or you might need to explore the possibility that these atoms are involve in some form of disorder: F16 F8 F2 F15 F1 F5 F6 F7 F10 F9 F3 F11 F13 F4 F17 F14. |
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