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kilian 2026-07-15 11:03:32 +02:00
parent 78973b52e3
commit 745a1e50e4
1 changed files with 22 additions and 0 deletions
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Vanilla/p-Coumaricacid/orca.xyz Normal file
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C 0.095412 -0.097916 -0.135373
C 0.940156 -1.015433 -0.765754
C 2.311179 -0.940113 -0.667268
C 2.914080 0.058647 0.068332
O 4.291070 0.182849 0.202054
C 2.105098 0.979255 0.702085
C 0.717563 0.888125 0.591727
H -4.990032 -1.122751 -0.346038
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H 0.524027 -1.818610 -1.355100
H 2.963648 -1.652111 -1.156566
H 4.860253 -0.660038 0.292489
H 2.537625 1.794807 1.300810
H 0.150804 1.623392 1.100482