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Figure 2
Monte Carlo positioning of a molecule of (I) by direct-space ESPOIR software produces the best fit (RP = 0.136) to the pseudo-powder pattern built from the previously extracted |Fhkl| (Fig. 1[link]).

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
Volume 69| Part 4| June 2013| Pages 395-404
doi:10.1107/S2052519213013365
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