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Acta Cryst. (2013). E69, m384  [ doi:10.1107/S1600536813015626 ]

Poly[hexaaqua([mu]9-cyclohexane-1,2,3,4,5,6-hexacarboxylato)trimanganese(II)]

W. Sun, H. Zang and C. Quan


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Alert level C PLAT094_ALERT_2_C Ratio of Maximum / Minimum Residual Density .... 2.67 PLAT314_ALERT_2_C Check Small Angle for H2O: Metal-O1W -H1B 92.65 Deg.
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 6 PLAT004_ALERT_5_G Info: Polymeric Structure Found with Dimension . 3 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? Do ! PLAT042_ALERT_1_G Calc. and Reported MoietyFormula Strings Differ ? Check PLAT045_ALERT_1_G Calculated and Reported Z Differ by ............ 3.00 Ratio PLAT083_ALERT_2_G SHELXL Second Parameter in WGHT Unusually Large. 11.10 PLAT232_ALERT_2_G Hirshfeld Test Diff (M-X) Mn1 -- O1W .. 6.9 su PLAT710_ALERT_4_G Delete 1-2-3 or 2-3-4 Linear Torsion Angle ... # 23 C1 -O1 -MN1 -O2 115.00 0.40 1.555 1.555 1.555 11.566 PLAT764_ALERT_4_G Overcomplete CIF Bond List Detected (Rep/Expd) . 1.29 Ratio PLAT793_ALERT_4_G The Model has Chirality at C2 (Verify) .... R PLAT793_ALERT_4_G The Model has Chirality at C3 (Verify) .... S PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 4
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 2 ALERT level C = Check. Ensure it is not caused by an omission or oversight 12 ALERT level G = General information/check it is not something unexpected 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 5 ALERT type 2 Indicator that the structure model may be wrong or deficient 1 ALERT type 3 Indicator that the structure quality may be low 4 ALERT type 4 Improvement, methodology, query or suggestion 2 ALERT type 5 Informative message, check

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