checkCIF procedure

PLAT109


PLAT109 Type_2 Test the twinning operation as alternate inversion twinning
 The SHELXL TWIN instruction matrix corresponds to an inverted 
 non-centrosymmetric pointgroup operation belonging to the corresponding 
 centrosymmetric Laue group. The reported twinning factor is actually the
 Flack x value. The close to zero CIF reported Flack parameter value is 
 meaningless.  Please re-refine with the TWIN instruction replaced by 'TWIN'
 (i.e. without numerical data).
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