[Open access]

[Contents scheme]

Acta Cryst. (2013). E69, m101
[ doi:10.1107/S1600536813000536 ]


L. Wang

Key indicators

checkCIF/PLATON results

No syntax errors found

Alert level C PLAT341_ALERT_3_C Low Bond Precision on C-C Bonds ............... 0.0077 Ang PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 1 C30 H28 Co2 O20 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 9.986 PLAT906_ALERT_3_C Large K value in the Analysis of Variance ...... 2.403 PLAT910_ALERT_3_C Missing # of FCF Reflections Below Th(Min) ..... 1 PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 2 PLAT975_ALERT_2_C Positive Residual Density at 1.04A from O10 . 0.43 eA-3
Alert level G PLAT002_ALERT_2_G Number of Distance or Angle Restraints on AtSite 11 PLAT005_ALERT_5_G No _iucr_refine_instructions_details in the CIF ? PLAT007_ALERT_5_G Note: Number of Unrefined D-H Atoms ............ 7 PLAT199_ALERT_1_G Check the Reported _cell_measurement_temperature 293 K PLAT200_ALERT_1_G Check the Reported _diffrn_ambient_temperature 293 K PLAT804_ALERT_5_G ARU-Pack Problem in PLATON Analysis ............ 71 Times PLAT860_ALERT_3_G Note: Number of Least-Squares Restraints ....... 9 PLAT912_ALERT_4_G Missing # of FCF Reflections Above STh/L= 0.600 3 PLAT961_ALERT_5_G Dataset Contains no Negative Intensities ....... !
0 ALERT level A = Most likely a serious problem - resolve or explain 0 ALERT level B = A potentially serious problem, consider carefully 7 ALERT level C = Check. Ensure it is not caused by an omission or oversight 9 ALERT level G = General information/check it is not something unexpected 2 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 2 ALERT type 2 Indicator that the structure model may be wrong or deficient 6 ALERT type 3 Indicator that the structure quality may be low 2 ALERT type 4 Improvement, methodology, query or suggestion 4 ALERT type 5 Informative message, check

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