Table 4. Data collection and processing.
Values in parentheses are for the outer shell.
| Diffraction source | 23-ID-B, APS |
| Wavelength (Å) | 1.033200 |
| Temperature (K) | 100 |
| Detector | EIGER |
| Crystal-to-detector distance (mm) | 200.0 |
| Rotation range per image (°) | 0.2 |
| Total rotation range (°) | 200 |
| Exposure time per image (s) | 0.2 |
| Space group | C2 |
| a, b, c (Å) | 111.72, 114.74, 79.97 |
| α, β, γ (°) | 90.0, 109.8, 90.0 |
| Resolution range (Å) | 1.65 (1.75–1.65) |
| Total No. of reflections | 431338 (70385) |
| No. of unique reflections | 111796 (17858) |
| Completeness (%) | 98.2 (97.2) |
| Multiplicity | 3.86 (3.94) |
| 〈I/σ(I)〉 | 22.08 (3.16) |
| R r.i.m. (%) | 3.6 (59.1) |