24
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La5034/step2_1_La5034.log	Energy: -231210.5926684
C         -1.44784       -0.05504        0.59087
C         -0.01485       -0.56944        0.62306
C         -2.02694       -0.15937       -0.81851
C         -1.09528        0.53228       -1.81152
C          0.32464       -0.00457       -1.68640
N          0.84947        0.15253       -0.32183
C          2.20544       -0.40367       -0.24229
C          3.20510        0.36600       -1.05460
C          4.00276       -0.18074       -1.97160
H         -1.46375        0.99169        0.92017
H         -2.04749       -0.62996        1.30401
H         -0.01255       -1.64977        0.38172
H          0.40763       -0.46034        1.62655
H         -3.03083        0.27542       -0.85934
H         -2.11975       -1.21938       -1.09133
H         -1.08998        1.61317       -1.62121
H         -1.44121        0.38550       -2.83987
H          0.98942        0.51914       -2.37848
H          0.33760       -1.07559       -1.96851
H          2.21255       -1.46306       -0.55595
H          2.51093       -0.37397        0.81026
H          3.27556        1.43307       -0.84319
H          3.94811       -1.24177       -2.20567
H          4.73605        0.41000       -2.51219