19
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La5031/step2_1_La5031.log	Energy: -158752.0959427
C         -3.60229        1.37701       -1.37174
N         -2.40196        0.93034       -0.66627
C         -1.23196        1.24017       -1.49786
C          0.11029        0.89849       -0.86529
C          1.26323        1.40470       -1.72771
C         -2.50292       -0.51230       -0.44813
H         -3.55052        2.45298       -1.55524
H         -4.48956        1.17209       -0.76800
H         -3.72065        0.86658       -2.34267
H         -1.25715        2.31482       -1.71224
H         -1.31503        0.71771       -2.47054
H          0.20705       -0.18470       -0.73742
H          0.16727        1.34788        0.13337
H          1.22144        0.96796       -2.73115
H          2.23037        1.14363       -1.28958
H          1.22486        2.49361       -1.83541
H         -3.43033       -0.73752        0.08342
H         -1.67180       -0.87456        0.15882
H         -2.50825       -1.06866       -1.40176