Accuracy

ch3ohr    599 Methanol (Geo)

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    #  Species Formula
   589 Hydronium, cationH3O
   590 Carbon monoxideCO
   591 Carbon monoxide (Geo)CO
   592 HCO, cationHCO
   593 HCOHCO
   594 Formaldehyde (Geo)CH2O
   595 FormaldehydeCH2O
   596 CH2OH, cationCH3O
   597 Methoxy, radicalCH3O
   598 Methoxy, anionCH3O
   599 Methanol (Geo) CH4O
   600 MethanolCH4O
   601 Ketene (Geo)C2H2O
   602 KeteneC2H2O
   603 AcetaldehydeC2H4O
   604 Acetaldehyde (Geo)C2H4O
   605 Ethylene oxideC2H4O
   606 Ethoxy, anionC2H5O
   607 Dimethyl ether (Geo)C2H6O
   608 Dimethyl etherC2H6O
   609 EthanolC2H6O


REF: R. M. Lees, J. G. Baker, J. Chem. Phys., 48, 5299 (1968).
  

Methanol
 GR=LB1968 <C-O> <C-H> <H-C-O> <O-H> <C-O-H>
  O     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.42500000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     1.09400000 +1  108.5000000 +1    0.0000000 +0     2     1     0
 XX     1.00000000 +0  127.9000000 +0 -176.4181420 +0     2     1     3
  H     0.94500000 +1  107.0000000 +1   63.6277872 +1     1     2     3
  H     1.09782528 +1   62.2458324 +1   86.0898836 +1     2     4     1
  H     1.09435111 +1   48.6289950 +1  -84.8364813 +1     2     4     1