EXOMOL.def                                                                      # ID
(1H)2(16O)2                                                                     # IsoFormula
1H2-16O2                                                                        # Iso-slug
APTY                                                                            # Isotopologue dataset name
20160726                                                                        # Version number with format YYYYMMDD
MHAJPDPJQMAIIY-UHFFFAOYSA-N                                                     # Inchi key of molecule
4                                                                               # Number of atoms
1                                                                               # Isotope number 1
H                                                                               # Element symbol 1
16                                                                              # Isotope number 2
O                                                                               # Element symbol 2
   34.005479 5.64674657e-26                                                     # Isotopologue mass (Da) and (kg)
D2h                                                                             # Symmetry group
8                                                                               # Number of irreducible representations
1                                                                               # Irreducible representation ID
A_g_                                                                            # Irreducible representation label
1                                                                               # Nuclear spin degeneracy
2                                                                               # Irreducible representation ID
A_u_                                                                            # Irreducible representation label
1                                                                               # Nuclear spin degeneracy
3                                                                               # Irreducible representation ID
B_1g_                                                                           # Irreducible representation label
1                                                                               # Nuclear spin degeneracy
4                                                                               # Irreducible representation ID
B_1u_                                                                           # Irreducible representation label
3                                                                               # Nuclear spin degeneracy
5                                                                               # Irreducible representation ID
B_2g_                                                                           # Irreducible representation label
0                                                                               # Nuclear spin degeneracy
6                                                                               # Irreducible representation ID
B_2u_                                                                           # Irreducible representation label
0                                                                               # Nuclear spin degeneracy
7                                                                               # Irreducible representation ID
B_3g_                                                                           # Irreducible representation label
0                                                                               # Nuclear spin degeneracy
8                                                                               # Irreducible representation ID
B_3u                                                                            # Irreducible representation label
0                                                                               # Nuclear spin degeneracy
 9000.00                                                                        # Maximum temperature of linelist
0                                                                               # No. of pressure broadeners available
0                                                                               # Dipole availability (1=yes, 0=no)
0                                                                               # No. of cross section files available
0                                                                               # No. of k-coefficient files available
1                                                                               # Lifetime availability (1=yes, 0=no)
0                                                                               # Lande g-factor availability (1=yes, 0=no)
7560352                                                                         # No. of states in .states file
2                                                                               # No. of quanta cases
stcs                                                                            # Quantum case label
TROVE                                                                           # Quantum case label
20                                                                              # No. of quanta defined
G                                                                               # Quantum label 1
I5 %5d                                                                          # Format quantum label 1
[1/8] Total symmetry                                                            # Description quantum label 1
v1                                                                              # Quantum label 2
I3 %3d                                                                          # Format quantum label 2
[0/16] normal mode vibrational quantum number                                   # Description quantum label 2
v2                                                                              # Quantum label 3
I3 %3d                                                                          # Format quantum label 3
[0/8]  normal mode vibrational quantum number                                   # Description quantum label 3
v3                                                                              # Quantum label 4
I3 %3d                                                                          # Format quantum label 4
[0/8] normal mode vibrational quantum number                                    # Description quantum label 4
v4                                                                              # Quantum label 5
I3 %3d                                                                          # Format quantum label 5
[0/14] normal mode torsional excitation quantum number                          # Description quantum label 5
v5                                                                              # Quantum label 6
I3 %3d                                                                          # Format quantum label 6
[0/14] normal mode vibrational quantum number                                   # Description quantum label 6
v6                                                                              # Quantum label 7
I3 %3d                                                                          # Format quantum label 7
[0/16] normal mode vibrational quantum number                                   # Description quantum label 7
tau                                                                             # Quantum label 8
I3 %3d                                                                          # Format quantum label 8
[1/4] normal mode torsional symmetry quantum number                             # Description quantum label 8
Gv                                                                              # Quantum label 9
I3 %3d                                                                          # Format quantum label 9
[1/4] D_2h_(M) vi. symmetry Gamma(v) (local mode)                               # Description quantum label 9
K                                                                               # Quantum label 10
I3 %3d                                                                          # Format quantum label 10
[0/85] Projection of J on axis of molec. symmetry                               # Description quantum label 10
Pr                                                                              # Quantum label 11
I3 %3d                                                                          # Format quantum label 11
[0/1] Rotational parity tau(rot)                                                # Description quantum label 11
Gr                                                                              # Quantum label 12
I5 %5d                                                                          # Format quantum label 12
[1/4] D_2h_(M) rot. symmetry Gamma(v) (local mode)                              # Description quantum label 12
N(Bl                                                                            # Quantum label 13
I8 %8d                                                                          # Format quantum label 13
[1/67238] Reference number in the polyad                                        # Description quantum label 13
C2                                                                              # Quantum label 14
F3.2 %3.2f                                                                      # Format quantum label 14
[0.0/1.00] Square of the largest coefficient                                    # Description quantum label 14
n1                                                                              # Quantum label 15
I3 %3d                                                                          # Format quantum label 15
[0/16] Local mode vibrational quantum number                                    # Description quantum label 15
n2                                                                              # Quantum label 16
I3 %3d                                                                          # Format quantum label 16
[0/8] Local mode vibrational quantum number                                     # Description quantum label 16
n3                                                                              # Quantum label 17
I3 %3d                                                                          # Format quantum label 17
[0/8] Local mode vibrational quantum number                                     # Description quantum label 17
n4                                                                              # Quantum label 18
I3 %3d                                                                          # Format quantum label 18
[0/14] Local mode vibrational quantum number                                    # Description quantum label 18
n6                                                                              # Quantum label 19
I3 %3d                                                                          # Format quantum label 19
[0/14] Local mode vibrational quantum number                                    # Description quantum label 19
n6                                                                              # Quantum label 20
I3 %3d                                                                          # Format quantum label 20
[0/16] Local mode vibrational quantum number                                    # Description quantum label 20
20000000                                                                        # Total number of transitions
60                                                                              # No. of transition files
 6000.00                                                                        # Maximum wavenumber (in cm-1)
 8000.00                                                                        # Higher energy with complete set of transitions (in cm-1)
 1500.00                                                                        # Maximum temperature of partition function
 1.00                                                                           # Step size of temperature
0                                                                               # Cooling function availability (1=yes, 0=no)
0.0700                                                                          # Default value of Lorentzian half-width for all lines (in cm-1/bar)
0.500                                                                           # Default value of temperature exponent for all lines
