| Label# | Conformer# | t1 | t2 | t3 | Search result |
|---|---|---|---|---|---|
| 1 | 1 | 60.0 | 60.0 | 0.0 | clash |
| 2 | 40 | 180.0 | 60.0 | 90.0 | conformer fit |
| 3 | 44 | 180.0 | 60.0 | −150.0 | modified fit 11 conformers |
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