10 ../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La3015-/step2_1_La3015-.log Energy: -456466.9286586 O 0.33715 0.92130 0.52603 O -0.58938 -0.61600 -0.81191 C 1.68830 -0.93241 -0.20060 C 0.38170 -0.14111 -0.15513 H 1.96317 -1.06900 -1.25069 H 1.48979 -1.92599 0.21361 C 2.80652 -0.25457 0.55910 H 2.58767 -0.15773 1.62056 H 3.05675 0.71971 0.14356 Cl 4.32956 -1.24231 0.45667