qm_property_calculation / dummy_struct.xyz
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C -2.88043 -1.28597 -0.35243
C -3.85827 -0.32948 -0.06403
C -3.49840 1.01644 0.10599
C -2.13926 1.39949 -0.01635
C -1.16786 0.42877 -0.30620
C -1.54028 -0.90827 -0.47306
H -4.89221 -0.64078 0.02580
C -4.46980 1.98716 0.39584
C -1.77939 2.74542 0.15367
H -0.12415 0.70304 -0.40338
H -0.78812 -1.65383 -0.69650
H -3.16207 -2.32290 -0.48281
C -4.09738 3.32420 0.56272
C -2.75723 3.70190 0.44209
H -5.51351 1.71289 0.49302
H -4.84954 4.06975 0.78617
H -0.74545 3.05671 0.06384
H -2.47558 4.73882 0.57249