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C    4.52101116e+01 7.71708263e+00 9.71918443e+00
C    5.07217540e+01 8.10407736e+00 4.15913777e+00
C    4.96303114e+01 8.08257000e+00 8.26984515e+00
C    4.63015524e+01 7.73858794e+00 2.70980003e+00
C    4.52697232e+01 7.73858689e+00 8.26984496e+00
C    5.06621420e+01 8.08257249e+00 2.70979912e+00
C    4.88623795e+01 9.24695004e+00 7.78066615e+00
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C    4.45017933e+01 6.57420726e+00 7.78066891e+00
C    5.14300711e+01 9.24695050e+00 2.22062171e+00
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H    4.57087382e+01 8.44853080e+00 3.75892285e-01
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H    5.24273598e+01 1.07894306e+01 4.89207087e-01
