29
E = -1013.75935297
H          1.03872        2.36254       -0.27254
O          1.95633        2.71108       -0.20319
C          2.64518        1.98371        0.79202
C          2.32420        0.49746        0.82691
H          3.72323        2.09357        0.59111
H          2.45183        2.38567        1.80700
H          3.07427       -0.02540        1.44937
O          1.00914        0.32432        1.42677
C          2.26924       -0.18716       -0.54160
C          0.32358       -0.75964        0.85414
H          1.86846        0.51470       -1.28771
O          3.55362       -0.67100       -0.88031
C          1.20891       -1.27664       -0.31819
H          0.23505       -1.58990        1.57763
N         -1.04867       -0.39782        0.50736
H          3.58525       -0.78672       -1.84448
F          1.80143       -2.44996        0.09589
F          0.48682       -1.58517       -1.44011
C         -1.31473        0.68367       -0.40890
C         -2.07332       -1.10292        1.06007
O         -0.36182        1.29236       -0.89689
N         -2.61460        0.96406       -0.68574
H         -1.78851       -1.90246        1.74541
C         -3.37201       -0.82112        0.77099
C         -3.59768        0.26080       -0.14011
H         -4.18191       -1.38898        1.22385
N         -4.86331        0.61555       -0.47110
H         -4.98828        1.36331       -1.14366
H         -5.66464        0.09409       -0.14477
