leonarski_fandClaude Opus 5
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The search runs in pass 1 of the rotation two-pass; pass 2 only reuses the
group it decided, so the result the CLI renders carried no search at all
and the whole report - operator correlations, the space-group candidate
table, the refused higher symmetry - was silently dropped on every
rotation dataset. Most costly of all, the "or <group> (indistinguishable
from these data)" line never appeared, so an enantiomorphic pair the
intensities genuinely cannot separate was reported as a single answer.
Carry pass 1's search into the returned result.
Also de-duplicate the alternatives when the centred-lattice test swaps the
metric-matching candidate into the answer: the group it displaced was left
out and the chosen one listed twice ("C2 or P21 or C2").
Co-Authored-By: Claude Opus 5 (1M context) <noreply@anthropic.com>