| Initial state | Final state | , , (Å) | , , (deg) | , , (Å) | , , (deg) |
| 10, 8, 9 | 90, 95, 90 | 10.525, 8.433, 9.696 | 90, 96.91, 90 | 11, 10, 10 | 90, 100, 90 | 10.525, 8.433, 9.696 | 90, 96.91, 90 | 10, 10, 10 | 90, 90, 90 | 10.525, 8.433, 9.696 | 90, 96.91, 90 | 13, 10, 10 | 90, 95, 90 | 10.525, 8.433, 9.696 | 90, 96.91, 90 | 12, 12, 12 | 90, 90, 90 | 10.525, 8.433, 9.696 | 90, 96.91, 90 | 10, 10, 10 | 85, 90, 88 | 10.525, 8.433, 9.696 | 90, 96.91, 90 | 8, 8, 8 | 90, 90, 90 | 10.525, 8.433, 9.696 | 90, 96.91, 90 |
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