28
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La5015/step2_1_La5015.log	Energy: -232736.6333502
C         -1.52208        0.18725        5.12945
C         -0.26355        1.04150        5.24444
C          1.00457        0.20454        5.39116
C          2.27400        1.04415        5.50556
C          3.54124        0.20488        5.64482
C          4.81227        1.04313        5.75468
C          6.07839        0.19945        5.87613
C          7.34393        1.04154        5.97719
N          8.59155        0.27179        6.07604
H         -2.42027        0.80332        5.02668
H         -1.64738       -0.44318        6.01633
H         -1.46676       -0.47321        4.25737
H         -0.35183        1.71452        6.10694
H         -0.17078        1.68230        4.35821
H          1.09246       -0.47040        4.52806
H          0.91287       -0.43744        6.27861
H          2.18746        1.71623        6.37081
H          2.36229        1.68830        4.61949
H          3.62579       -0.46750        4.77970
H          3.45459       -0.43886        6.53120
H          4.73411        1.70876        6.62542
H          4.89348        1.69305        4.87239
H          6.16147       -0.46462        5.00451
H          6.00836       -0.44717        6.76185
H          7.27860        1.69625        6.85250
H          7.41735        1.69442        5.10112
H          8.64397       -0.34919        5.27053
H          8.51900       -0.34653        6.88187