Input information for AMPLIMODES for FullProf: high symmetry phase information (virtual prototype structure), low symmetry structure information (cell parameters obtained by XRPD data refinement) and transformation matrix. \operatorname{Pm} \overline{3} m (ITA No. 221, standard setting), Pbnm (ITA No. 62, nonstandard setting) and R \overline{3} c (ITA No. 167, standard setting).
| High symmetry structure | |||||
|---|---|---|---|---|---|
| 221 | |||||
| 3.84383 .84383 .843890 .0090 .0090 .00 | |||||
| 4 | |||||
| Fe | 0.00000 | 0.00000 | |||
| Sr | 0.50000 | 0.50000 | |||
| O | 0.00000 | 0.50000 | |||
| Low symmetry structure | Low symmetry structure | ||||
| 062 | 167 | ||||
| 5.53505 .54347 .824690 .0090 .0090 .00 | 5.59735 .597313 .718190 .0090 .00120 .00 | ||||
| Transformation matrix | Transformation matrix | ||||
| \left(\begin{array}{ccc\ | c}1 & 1 & 0 & 1 / 2 \\ -1 & 1 & 0 & 1 / 2 \\ 0 & 0 & 2 & 0\end{array}\right) | \left(\begin{array}{rrr\ | r}0 & 1 & 2 & 0 \\ -1 & 0 & 2 & 0 \\ 1 & -1 & 2 & 0\end{array}\right) |