16
../calculations/M062X_631+Gdp_SDD_SMD_SAS_Alpha0485/La5007/step2_1_La5007.log	Energy: -134106.3390788
C         -1.14566        0.75169        3.23757
C          0.19043        1.36757        3.64422
C          1.40049        0.52017        3.26259
C          2.69840        1.20504        3.66110
N          1.32768       -0.79427        3.92572
H         -1.97086        1.44208        3.43377
H         -1.35487       -0.16965        3.79040
H         -1.15488        0.51355        2.16800
H          0.21070        1.53833        4.72912
H          0.30019        2.34741        3.16477
H          1.39306        0.40368        2.16715
H          2.79101        2.17447        3.16286
H          3.56696        0.59773        3.38549
H          2.72574        1.37004        4.74417
H          2.14105       -1.34046        3.64925
H          0.52471       -1.30524        3.56518