# runs are executed in the same order as in this file
# the second field tells which test should be run in order to compare with the last available output
# see regtest/TEST_FILES
ch2o-1.inp                                             1    1.0E-14              -5.82072731467941
ch2o-2.inp                                             1    1.0E-14              -5.82159061359821
ch2o-3.inp                                             1    1.0E-14              -5.81373413468792
ch2o-r.inp                                             1    1.0E-14              -5.81373413468792
h2-1.inp                                               1    1.0E-14              -0.70875565358819
h2-2.inp                                               1    1.0E-14              -0.70875565358819
h2-3.inp                                               1    1.0E-14              -0.70875565358819
h2-4.inp                                               1      3e-14           -0.71042952969308004
h2o-32_1.inp                                           1      6e-13            -131.08636939008761
h2o-32_2.inp                                           1      4e-13            -131.07999691054360
h2o-32_3.inp                                           1      9e-14            -131.07520911566399
h2o-32_4.inp                                           1      2e-13            -131.07520911521166
MoS.inp                                                1    1.0E-14              -2.99616182900092
n2.inp                                                 1    1.0E-14              -4.86560729572791
s2.inp                                                 1    1.0E-14              -4.83731808711857
# atomic properties
ch2o_atprop.inp                                        1    1.0E-14              -5.81281420275335
MoS_atprop.inp                                         1    1.0E-14              -2.99616182900092
h2o-32_atprop.inp                                      1      6e-13            -131.08636939008761
#
co2_1.inp                                              1    1.0E-14              -8.55586246566686
co2_2.inp                                              1    1.0E-14              -8.55586246566686
co2_3.inp                                              1    1.0E-14              -8.55586246566686
#
si_kp1.inp                                             1    1.0E-13             -10.06358203475393
si_kp2.inp                                             0
#EOF
