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kilian 2026-07-16 13:32:58 +02:00
parent 2fc475a38c
commit 00fbb99ebb
5 changed files with 4647 additions and 2091 deletions
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34
Vanilla/3,4-Dihydroxybenzaldehyd/orca.xyz
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Vanilla/3,4-Dihydroxybenzaldehyd/orca_opt.out
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Vanilla/3,4-Dihydroxybenzaldehyd/orca_opt.xyz
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2163
Vanilla/3,4-Dihydroxybenzaldehyd/orca_sscc.out
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234
Vanilla/3,4-Dihydroxybenzaldehyd/orca_trj.xyz Normal file
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