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

zirconium dioxide   4655 Zirconium dioxide

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    #  Species Formula
  4645 ZrC12 (JANDIL10)C14H16Zr
  4646 Zirconium tetra(neopentyl)C20H44Zr
  4647 Bicyclopentadienyl biphenyl zirconiumC22H20Zr
  4648 Tetrabenzyl zirconiumC28H28Zr
  4649 Zirconium nitrideNZr
  4650 Zirconium tetra(dimethylamine)C8H24N4Zr
  4651 Zirconium tetra(diethylamine)C16H40N4Zr
  4652 Zr(II)(NH3)6H18N6Zr
  4653 Zr(II)(NH3)6 (Geo)H18N6Zr
  4654 Zirconium oxideOZr
  4655 Zirconium dioxide O2Zr
  4656 Zirconium tetraisopropoxideC12H28O4Zr
  4657 Zr(II)(H2O)6H12O6Zr
  4658 Zr(II)(H2O)6 (Geo)H12O6Zr
  4659 Zirconium fluorideFZr
  4660 Zirconium(I) fluorideFZr
  4661 Zirconium(I) fluoride (Geo)FZr
  4662 Zirconium difluorideF2Zr
  4663 Zr(IV)(Cp)2F2 (FDCPZR) (Geo)C10H10F2Zr
  4664 Zr(IV)(Cp)2F2 (FDCPZR)C10H10F2Zr
  4665 Zirconium(IV) oxide difluorideOF2Zr


ΔHf: -68.4 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 SYMMETRY PM7
Zirconium dioxide
 H=-68.4 HR=NIST
  O     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Zr     1.79496169 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     1.79496169 +0  111.0314754 +1    0.0000000 +0     2     1     0