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Acta Cryst. (2005). E61, m1506-m1508  [ doi:10.1107/S1600536805021100 ]

Bis(piperazinium) di-[mu]-chloro-bis[tetrachlorobismuthate(III)] trihydrate

P.-F. Wu, X.-F. Tan, X.-G. Meng, D.-S. Li, Y.-L. Zhu and Y.-G. Wei

Online 9 July 2005


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Alert level B PLAT029_ALERT_3_B _diffrn_measured_fraction_theta_full Low ....... 0.95 PLAT232_ALERT_2_B Hirshfeld Test Diff (M-X) Bi - Cl1 .. 10.41 su
Alert level C REFLT03_ALERT_3_C Reflection count < 95% complete From the CIF: _diffrn_reflns_theta_max 28.25 From the CIF: _diffrn_reflns_theta_full 28.25 From the CIF: _reflns_number_total 3240 TEST2: Reflns within _diffrn_reflns_theta_max Count of symmetry unique reflns 3424 Completeness (_total/calc) 94.63% PLAT042_ALERT_1_C Calc. and Rep. MoietyFormula Strings Differ .... ? PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Bi - Cl2 .. 9.48 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Bi - Cl4 .. 5.72 su PLAT232_ALERT_2_C Hirshfeld Test Diff (M-X) Bi - Cl1_a .. 8.07 su PLAT342_ALERT_3_C Low Bond Precision on C-C bonds (x 1000) Ang ... 10 PLAT720_ALERT_4_C Number of Unusual/Non-Standard Label(s) ........ 4 PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 4 H2 O
0 ALERT level A = In general: serious problem 2 ALERT level B = Potentially serious problem 8 ALERT level C = Check and explain 0 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 4 ALERT type 2 Indicator that the structure model may be wrong or deficient 3 ALERT type 3 Indicator that the structure quality may be low 2 ALERT type 4 Improvement, methodology, query or suggestion

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