13
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La19-/step2_1_La19-.log	Energy: -418660.9915567
S         -1.10021        2.07961        0.18072
C         -1.06128        0.24312        0.05643
H         -1.57142       -0.19793        0.92060
H         -1.60686       -0.07201       -0.83822
C          0.33503       -0.35000       -0.01851
H          0.89039        0.11278       -0.84751
C          0.28204       -1.84994       -0.24282
H         -0.20904       -2.06651       -1.19767
H         -0.28341       -2.32273        0.56890
O          1.62681       -2.33294       -0.25347
H          1.60917       -3.29651       -0.19480
O          1.01653       -0.07750        1.20874
H          1.84734       -0.57400        1.19119