(H2O)4...H35Cl covalent Fri Aug 23 23:17:01 2024 17 94 20 0 0.0000E+000 3.5000E+001 1.0000E+000 1.0000000000 a 4 1 0 ,,,,,,,,,,,,,,,,,, 10000 2.556947069392370E+003 1.00000000E+001 /A 20000 1.010543327112000E+003 1.00000000E+001 /B 30000 8.531673118634757E+002 1.00000000E+001 /C 200 -2.418670331933973E-003 1.00000000E+001 /-DeltaJ 1100 1.020667312912896E-002 1.00000000E+001 /-DeltaJK 2000 0.000000000000000E+000 1.00000000E-037 /-DeltaK 40100 -1.053552163500934E-004 1.00000000E+001 /-deltaJ 41000 0.000000000000000E+000 1.00000000E-037 /-deltaK 300 0.000000000000000E+000 1.00000000E-037 /PhiJ 1200 0.000000000000000E+000 1.00000000E-037 /PhiJK 2100 0.000000000000000E+000 1.00000000E-037 /PhiKJ 3000 0.000000000000000E+000 1.00000000E-037 /PhiK 110010000 -1.885112506558200E+001 1.00000000E+001 /1.5*Xaa 110040000 -8.825130438082568E-002 1.00000000E+001 /(Xb-Xc)/4 110610000 2.685480007164343E+001 1.00000000E+001 /chiab 110410000 2.771666661418892E+001 1.00000000E+001 /chiac 110210000 -1.968010506447134E+001 1.00000000E+001 /chibc ! !----------------------------------------------------------------------- ! Fit to original Hamburg data with A-reduction parameters ! as converted from PGOPHER to SPFIT ! ! MICROWAVE RMS = 0.004558 MHz ! RMS ERROR= 0.45579 0.45579 ! (H2O)4...H35Cl covalent Fri Aug 23 23:17:01 2024 17 94 20 0 0.0000E+000 3.5000E+001 1.0000E+000 1.0000000000 a 4 1 0 ,,,,,,,,,,,,,,,,,, 10000 2.556947069392370E+003 1.00000000E+001 /A 20000 1.010543327112000E+003 1.00000000E+001 /B 30000 8.531673118634757E+002 1.00000000E+001 /C 200 -2.418670331933973E-003 1.00000000E+001 /-DeltaJ 1100 1.020667312912896E-002 1.00000000E+001 /-DeltaJK 2000 0.000000000000000E+000 1.00000000E-037 /-DeltaK 40100 -1.053552163500934E-004 1.00000000E+001 /-deltaJ 41000 0.000000000000000E+000 1.00000000E-037 /-deltaK 300 0.000000000000000E+000 1.00000000E-037 /PhiJ 1200 0.000000000000000E+000 1.00000000E-037 /PhiJK 2100 0.000000000000000E+000 1.00000000E-037 /PhiKJ 3000 0.000000000000000E+000 1.00000000E-037 /PhiK 110010000 -1.885112506558200E+001 1.00000000E+001 /1.5*Xaa 110040000 -8.825130438082568E-002 1.00000000E+001 /(Xb-Xc)/4 110610000 2.685480007164343E+001 1.00000000E+001 /chiab 110410000 2.771666661418892E+001 1.00000000E+001 /chiac 110210000 -1.968010506447134E+001 1.00000000E+001 /chibc ! !-----------------------------------------------------------------------