10
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La30-/step2_1_La30-.log	Energy: -334345.0476945
S         -0.26448        0.90729        0.94890
H         -0.71498       -1.33053        1.80920
H         -0.75818       -1.30269        0.04823
C         -0.20955       -0.93329        0.92245
C          1.20781       -1.48118        0.87837
H          1.72576       -1.06136        0.00539
H          1.75218       -1.14885        1.76741
N          1.19841       -2.95322        0.86986
H          2.15919       -3.28587        0.84510
H          0.78127       -3.26471       -0.00505