13
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La3019-/step2_1_La3019-.log	Energy: -481125.5631137
O          0.23376        0.94603        0.51594
O         -0.68078       -0.58703       -0.83140
C          1.59659       -0.90304       -0.21501
C          0.29107       -0.11378       -0.16867
H          1.85296       -1.04619       -1.27078
H          1.38125       -1.90050        0.18622
C          2.75902       -0.26639        0.53731
H          2.50125       -0.14352        1.59384
H          2.97143        0.72690        0.12947
C          3.98713       -1.14240        0.41117
H          3.83305       -2.12936        0.84650
Cl         5.39974       -0.42628        1.30608
H          4.31483       -1.24432       -0.62305