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Coordinates from ORCA-job buthen E -156.105287006482
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  H       1.078517     -1.473420     -0.000173
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  H      -2.245632     -0.493601     -0.875165
  H      -1.078520     -1.473420      0.000052
12
Coordinates from ORCA-job buthen E -156.105333617079
  C       1.593084     -0.520620      0.000004
  H       2.240979     -0.493205     -0.872700
  H       1.073871     -1.470399     -0.000139
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  H      -1.155648      1.619384     -0.000014
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  H      -2.240873     -0.493293     -0.872794
  H      -1.073873     -1.470398      0.000022
12
Coordinates from ORCA-job buthen E -156.105334659059
  C       1.592526     -0.520847      0.000007
  H       2.240824     -0.493115     -0.872550
  H       1.073019     -1.470405     -0.000123
  H       2.240648     -0.493254      0.872699
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  H      -2.240726     -0.493192     -0.872644
  H      -1.073020     -1.470403      0.000013
