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ÍûÄĸö´óÏÀÄܽâ¾öÏÂÃæµÄ´íÎó£¬ÓÈÆäÊÇAÀࡣлл£¡ Alert level A PLAT601_ALERT_2_A Structure Contains Solvent Accessible VOIDS of . 245 A**3 --------------------------------------------------------------------------------Alert level C ABSTY02_ALERT_1_C An _exptl_absorpt_correction_type has been given without a literature citation. This should be contained in the _exptl_absorpt_process_details field. Absorption correction given as MULTI-SCAN STRVA01_ALERT_2_C Chirality of atom sites is inverted? From the CIF: _refine_ls_abs_structure_Flack 10.000 From the CIF: _refine_ls_abs_structure_Flack_su 10.000 PLAT033_ALERT_4_C Flack x Parameter Value Deviates from Zero ..... 10.00 PLAT089_ALERT_3_C Poor Data / Parameter Ratio (Zmax .LT. 18) ..... 7.86 PLAT220_ALERT_2_C Large Non-Solvent O Ueq(max)/Ueq(min) ... 3.24 Ratio PLAT234_ALERT_4_C Large Hirshfeld Difference O7 -- N1 .. 0.15 Ang. PLAT242_ALERT_2_C Check Low Ueq as Compared to Neighbors for N1 PLAT340_ALERT_3_C Low Bond Precision on C-C Bonds (x 1000) Ang .. 8 --------------------------------------------------------------------------------Alert level G REFLT03_ALERT_4_G Please check that the estimate of the number of Friedel pairs is correct. If it is not, please give the correct count in the _publ_section_exptl_refinement section of the submitted CIF. From the CIF: _diffrn_reflns_theta_max 25.50 From the CIF: _reflns_number_total 1612 Count of symmetry unique reflns 1612 Completeness (_total/calc) 100.00% TEST3: Check Friedels for noncentro structure Estimate of Friedel pairs measured 0 Fraction of Friedel pairs measured 0.000 Are heavy atom types Z>Si present no PLAT032_ALERT_4_G Std. Uncertainty on Flack Parameter Value High . 10.00 PLAT791_ALERT_4_G Note: The Model has Chirality at C1 (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C2 (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C3 (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C4 (Verify) R PLAT791_ALERT_4_G Note: The Model has Chirality at C5 (Verify) R PLAT981_ALERT_1_G No non-zero f" Anomalous Scattering Values Found ? -------------------------------------------------------------------------------- |
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