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Dateien nach "Vanilla/4-Hydroxybenzaldehyd" hochladen

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kilian 2026-07-15 11:00:59 +02:00
parent 859bc51ed6
commit 85842e68cd
1 changed files with 17 additions and 0 deletions
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17
Vanilla/4-Hydroxybenzaldehyd/orca.xyz Normal file
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@ -0,0 +1,17 @@
15
C -2.596402 0.131230 -0.074418
O -3.185945 -0.999533 -0.032262
C -1.137897 0.114223 -0.064624
C -0.510146 -1.112736 -0.010985
C 0.886606 -1.185594 0.000668
C 1.609414 -0.003754 -0.042727
O 2.994835 -0.131180 -0.028939
C 0.997237 1.237206 -0.096834
C -0.393078 1.263546 -0.106565
H -3.178461 1.041974 -0.114978
H -1.038777 -2.055724 0.023928
H 1.377187 -2.133676 0.042141
H 3.450537 -0.528115 0.783688
H 1.593759 2.136996 -0.129583
H -0.868870 2.225138 -0.148510