Alert level B
PLAT222_ALERT_3_B Large Non-Solvent H Ueq(max)/Ueq(min) ... 4.56 Ratio
Alert level C
CRYSC01_ALERT_1_C The word below has not been recognised as a standard
identifier.
unknown
CRYSC01_ALERT_1_C No recognised colour has been given for crystal colour.
PLAT390_ALERT_3_C Deviating Methyl C4 X-C-H Bond Angle ...... 102.40 Deg.
PLAT024_ALERT_4_C Merging of Friedel Pairs is Indicated .......... !
PLAT194_ALERT_1_C Missing _cell_measurement_reflns_used datum .... ?
PLAT195_ALERT_1_C Missing _cell_measurement_theta_max datum .... ?
PLAT196_ALERT_1_C Missing _cell_measurement_theta_min datum .... ?
PLAT790_ALERT_4_C Centre of Gravity not Within Unit Cell: Resd. # 1
C25 H30 O7
Alert level G
REFLT03_ALERT_4_G ALERT: MoKa measured Friedel data cannot be used to
determine absolute structure in a light-atom
study EXCEPT under VERY special conditions.
It is preferred that Friedel data is merged in such cases.
From the CIF: _diffrn_reflns_theta_max 26.37
From the CIF: _reflns_number_total 4408
Count of symmetry unique reflns 2307
Completeness (_total/calc) 191.07%
TEST3: Check Friedels for noncentro structure
Estimate of Friedel pairs measured 2101
Fraction of Friedel pairs measured 0.911
Are heavy atom types Z>Si present no
PLAT791_ALERT_4_G The Model has Chirality at C11 (Verify) .... S
PLAT791_ALERT_4_G The Model has Chirality at C12 (Verify) .... R
PLAT791_ALERT_4_G The Model has Chirality at C13 (Verify) .... S
PLAT791_ALERT_4_G The Model has Chirality at C16 (Verify) .... R
0 ALERT level A = In general: serious problem 1 ALERT level B = Potentially serious problem 8 ALERT level C = Check and explain 5 ALERT level G = General alerts; check 5 ALERT type 1 CIF construction/syntax error, inconsistent or missing data 0 ALERT type 2 Indicator that the structure model may be wrong or deficient 2 ALERT type 3 Indicator that the structure quality may be low 7 ALERT type 4 Improvement, methodology, query or suggestion 0 ALERT type 5 Informative message, check
