#model=uma(size=uma-s-1p1,task=omol)
#parmfit(method=refinement,input=Refine2.in)
#device=gpu0

I     3.54000000    1.42000000    0.00000000
C     3.55600000    1.47900000   -2.08800000
C     4.63400000    0.90600000   -2.76200000
H     5.45500000    0.43700000   -2.22200000
C     4.67700000    0.92700000   -4.15700000
H     5.51600000    0.48000000   -4.68200000
C     3.64100000    1.52200000   -4.87700000
H     3.67400000    1.53800000   -5.96300000
C     2.56300000    2.09500000   -4.20400000
H     1.76000000    2.55700000   -4.77200000
C     2.52000000    2.07400000   -2.80900000
O     1.44800000    2.64500000   -2.18900000
H     1.53600000    2.56400000   -1.22800000