PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

feohr   3341 FeOH (Geo)

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    #  Species Formula
  3331 [Fe(II)(CN)6](4-) (Geo)C6N6Fe
  3332 Fe(II)(en)3C6H24N6Fe
  3333 Fe(II)(en)3 (Geo)C6H24N6Fe
  3334 cis-Dicyanotetra(methylisocyanide) iron(ii) (CNMCFE) (Geo)C10H12N6Fe
  3335 Ferrous tris(ortho phenantholine)C36H24N6Fe
  3336 Ferrous tris(ortho phenantholine) (Geo)C36H24N6Fe
  3337 FeO(+)OFe
  3338 FeOOFe
  3339 FeO (Geo)OFe
  3340 FeOHHOFe
  3341 FeOH (Geo) HOFe
  3342 FeC9 (BUDFEC01) (Geo)C9H12OFe
  3343 FeC9 (BUDFEC01)C9H12OFe
  3344 FeCO(1,3-C4H6)2C9H12OFe
  3345 FeCO(1,3-C4H6)2 (Geo)C9H12OFe
  3346 FeO2 3B1O2Fe
  3347 FeO2 5B2O2Fe
  3348 Fe(OH)2H2O2Fe
  3349 Methyl iron(III) dihydroxide (Geo)CH5O2Fe
  3350 FeCp(CO)2(CN) (ACODUR) (Geo)C8H5NO2Fe
  3351 FeCp(CO)2(CN) (ACODUR)C8H5NO2Fe


REF: No reference available, but data are consistent with other data.
  
 OPEN(3,4) SHIFT=5 PM7
FeOH
 GR=DUMMY <Fe-O>
 Fe     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     1.83500000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  H     0.94196374 +1  116.7610450 +1    0.0000000 +1     2     1     0