12
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La5-/step2_1_La5-.log	Energy: -683626.8735757
S          2.20584        1.91745        0.26966
C          2.16133       -2.66010        0.01571
C          3.37743       -1.98738        0.05557
C          3.38198       -0.59700        0.13502
C          2.18856        0.14860        0.17460
C          0.98099       -0.57381        0.13409
H          0.01412       -2.49667        0.02363
H          0.03822       -0.03610        0.16399
C          0.95847       -1.96403        0.05450
H          4.33505       -0.07780        0.16499
H          4.31129       -2.53826        0.02498
Cl         2.14471       -4.41387       -0.08669