22
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La5012/step2_1_La5012.log	Energy: -183420.4004480
C         -3.79551       -0.35158       -0.00650
C         -2.52868        0.49686       -0.04954
C         -1.25622       -0.34321        0.01714
C          0.02142        0.49070       -0.01974
C          1.29130       -0.35475        0.02171
C          2.56074        0.48700        0.02151
N          3.81235       -0.28240        0.03903
H         -4.69704        0.26615       -0.05681
H         -3.84171       -0.93737        0.91786
H         -3.82288       -1.05383       -0.84667
H         -2.53335        1.20954        0.78515
H         -2.51654        1.09514       -0.96959
H         -1.24973       -1.05471       -0.82054
H         -1.26905       -0.94562        0.93635
H          0.02188        1.18882        0.82886
H          0.02629        1.10677       -0.92965
H          1.31143       -1.03073       -0.84443
H          1.28391       -0.98940        0.91892
H          2.55828        1.15039        0.89271
H          2.57115        1.13122       -0.86394
H          3.80833       -0.90992       -0.76299
H          3.79568       -0.89428        0.85288