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

nbcl3r   4759 Niobium trichloride (Geo)

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    #  Species Formula
  4749 Nb(V)S4(3-) (JUMNAG) (Geo)S4Nb
  4750 Nb(V)S4(3-) (JUMNAG)S4Nb
  4751 Dimethyl niobium chlorideC2H6ClNb
  4752 Dimethyl niobium chloride (Geo)C2H6ClNb
  4753 Niobium(III) oxide chloride (Geo)OClNb
  4754 Niobium(III) oxide chlorideOClNb
  4755 Nb(Cp)2S2Cl (BAPKUY) (Geo)C10H10S2ClNb
  4756 Nb(Cp)2S2Cl (BAPKUY)C10H10S2ClNb
  4757 Nb(Cp)Cl2N (JIYMAF10) (Geo)C6H8NCl2Nb
  4758 Nb(Cp)Cl2N (JIYMAF10)C6H8NCl2Nb
  4759 Niobium trichloride (Geo) Cl3Nb
  4760 Niobium(III) trichlorideCl3Nb
  4761 Niobium(V) oxide trichloride (Geo)OCl3Nb
  4762 Niobium(V) oxide trichlorideOCl3Nb
  4763 Nb(V)Cl3N2O (ACYNNB10) (Geo)C4H6N2OCl3Nb
  4764 Nb(V)Cl3N2O (ACYNNB10)C4H6N2OCl3Nb
  4765 niobium(V) tetrachloride, cationCl4Nb
  4766 Nb(IV)Cl4N2 (CYANBA) (Geo)C4H6N2Cl4Nb
  4767 Nb(IV)Cl4N2 (CYANBA)C4H6N2Cl4Nb
  4768 Nb(V)Cl4O2 (WIGKIG) (Geo)C12H17O2Cl4Nb
  4769 Nb(V)Cl4O2 (WIGKIG)C12H17O2Cl4Nb


REF: DGAUSS using the Lee-Parr-Yang correlation functional, in CAChe 5.0, Fujitsu Ltd, 2001.
  
 SYMMETRY PM7
Niobium trichloride
 <Nb-Cl> GR=B88_LYP
 Cl     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Nb     2.31300000 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.31300000 +1  120.0000000 +1    0.0000000 +0     2     1     0
 Cl     2.31300000 +1  120.0000000 +1  180.0000000 +1     2     1     3