Temperature induced single-crystal-to-single-crystal transformations and structure directed effects on magnetic properties.
Legrand, Yves-Marie; van der Lee, Arie; Masquelez, Nathalie; Rabu, Pierre; Barboiu, Mihail; Inorganic chemistry 46 (2007) 9083–9089; doi:10.1021/ic700867b

data_4333385
_publ_section_title
;
 Temperature induced single-crystal-to-single-crystal transformations and
 structure directed effects on magnetic properties.
;
_journal_issue                   22
_journal_name_full               'Inorganic chemistry'
_journal_page_first              9083
_journal_page_last               9089
_journal_paper_doi               10.1021/ic700867b
_journal_volume                  46
_journal_year                    2007
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_computing_molecular_graphics    'CAMERON (Watkin et al 1996)'
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_diffrn_measurement_method       \w
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; 
AbsPack - CrysAlis RED (Oxford Diffraction, 2002)
;
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;
 Method, part 1, Chebychev polynomial, (Watkin, 1994, Prince, 1982) 
 [weight] = 1.0/[A~0~*T~0~(x)+A~1~*T~1~(x) ... +A~n-1~]*T~n-1~(x)] 
 where A~i~ are the Chebychev coefficients listed below and x= Fcalc/Fmax 
 Method = Robust Weighting (Prince, 1982) 
 W = [weight] * [1-(deltaF/6*sigmaF)^2^]^2^ 
 A~i~ are: 
 13.1 -11.0 9.30 
;
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_reflns_threshold_expression     I>2.00u(I)
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_oxford_refine_ls_scale          7.051(6)
_oxford_structure_analysis_title mih10T95
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_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to /home/saulius/struct/CIF-dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 1891 2012-01-12 08:04:46Z andrius 

 Adding full bibliography for 4333385--4333393.cif.
;
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_original_formula_sum        'C10 H16 Co1 N2 O10 S2'
_cod_database_code               4333385