Force constants for  z_trans
Analytic_derivative == 0.013665928861826174 Hartree/Ang^2
Numeric_derivative == 0.019693516335370604 Hartree/Ang^2
Force constants for  mof5_ytrans
Analytic_derivative == 4.756693944367121e-06 Hartree/Ang^2
Numeric_derivative == 0.0 Hartree/Ang^2
Force constants for  mof5_xtrans
Analytic_derivative == 4.391729699472497e-06 Hartree/Ang^2
Numeric_derivative == 111.02230246251563 Hartree/Ang^2
Force constants for  smooth_c3
Analytic_derivative == 0.0012582758058048025 Hartree/Ang^2
Numeric_derivative == 0.0013698111106378143 Hartree/Ang^2
Force constants for  y_trans
Analytic_derivative == 0.009231205575136386 Hartree/Ang^2
Numeric_derivative == 0.007623296525288702 Hartree/Ang^2
Force constants for  x_stretch
Analytic_derivative == 4.871889713579602 Hartree/Ang^2
Numeric_derivative == -0.7589414990558095 Hartree/Ang^2
Force constants for  smooth_x_trans
Analytic_derivative == 0.04724506874184786 Hartree/Ang^2
Numeric_derivative == 0.04685151186011992 Hartree/Ang^2
Force constants for  mof5_ztrans
Analytic_derivative == 1.2544626893579016e-06 Hartree/Ang^2
Numeric_derivative == 0.0 Hartree/Ang^2
Force constants for  x_trans
Analytic_derivative == 0.018960310761731762 Hartree/Ang^2
Numeric_derivative == 0.018634724839594604 Hartree/Ang^2
relaxed_zphi_b97-d.dat
relaxed_zphi.dat
h2_b97d_radians.dat
y_theta.dat
z_trans.dat
h2_mv_svp.dat
h2_b97d.dat
mof5_ytrans.dat
mof5_xtrans.dat
mode_2.dat
smooth_c3.dat
he2.dat
mode_3.dat
mode_1.dat
z_phi.dat
y_trans.dat
mode_4.dat
mode_5.dat
h2_on_vmfu.dat
x_stretch.dat
mode_6.dat
smooth_x_trans.dat
mof5_ztrans.dat
x_trans.dat
e_phi.dat
e_theta.dat