8
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La3006-/step2_1_La3006-.log	Energy: -167308.2457584
O         -0.51127        0.78238        0.16067
O         -1.51590       -0.73276       -1.14860
C          0.75157       -1.09803       -0.60340
C         -0.51270       -0.28374       -0.51904
C          1.89281       -0.73938       -0.01691
H          0.68314       -2.01555       -1.18194
H          1.96357        0.17823        0.56053
H          2.78603       -1.35062       -0.09813