29
E = -1013.74248737
H         -3.80635        2.89856        0.65119
O         -3.74009        2.13065        0.06157
C         -2.34460        1.87901       -0.16706
C         -2.28687        0.48443       -0.78022
H         -1.90565        2.59500       -0.88233
H         -1.75330        1.92471        0.75834
H         -3.03799        0.44205       -1.58819
O         -1.00032        0.21745       -1.38422
C         -2.55291       -0.65136        0.21945
C         -0.28508       -0.73526       -0.63829
H         -3.12940       -0.29916        1.09063
O         -3.13479       -1.79881       -0.38773
C         -1.12451       -1.03869        0.63512
H         -0.24344       -1.68900       -1.19529
N          1.10554       -0.35137       -0.41473
H         -3.96146       -1.50684       -0.80910
F         -0.98882       -2.35616        0.98017
F         -0.73388       -0.30841        1.72122
C          1.46933        0.95596        0.12441
C          2.06936       -1.26118       -0.72928
O          0.59151        1.76408        0.38333
N          2.80434        1.18930        0.30382
H          1.71582       -2.20773       -1.14147
C          3.39101       -1.00661       -0.53797
C          3.71499        0.27991        0.00302
H          4.14655       -1.74289       -0.80358
N          5.01837        0.62048        0.19731
H          5.74638       -0.08026        0.16392
H          5.20063        1.49361        0.67975
