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Acta Cryst. (2010). E66, o1165-o1166  [ doi:10.1107/S1600536810013164 ]


N. Çolak, D. Aksakal, Ö. Andaç and O. Büyükgüngör

Online 24 April 2010

Key indicators

checkCIF/PLATON results

No syntax errors found

Alert level C PLAT230_ALERT_2_C Hirshfeld Test Diff for C4 -- C8 .. 5.37 su PLAT230_ALERT_2_C Hirshfeld Test Diff for C11 -- C15 .. 6.68 su PLAT371_ALERT_2_C Long C(sp2)-C(sp1) Bond C11 - C15 ... 1.44 Ang. PLAT911_ALERT_3_C Missing # FCF Refl Between THmin & STh/L= 0.600 7 PLAT920_ALERT_1_C Theta(Max) in CIF and FCF Differ by ........... 0.25 Deg.
Alert level G PLAT063_ALERT_4_G Crystal Size Likely too Large for Beam Size .... 0.80 mm
0 ALERT level A = In general: serious problem 0 ALERT level B = Potentially serious problem 5 ALERT level C = Check and explain 1 ALERT level G = General alerts; check 1 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 3 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 1 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check

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