Accuracy

Y(III)N6(3-) (KAKQES) r   4598 Y(III)N6(3-) (KAKQES) (Geo)

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    #  Species Formula
  4588 Y(III)O8 (ERUYAR) (Geo)C19H13O8F18Y
  4589 Y(III)O8 (ERUYAR)C19H13O8F18Y
  4590 Y(III)O8(-) (CYSFAC10) (Geo)C20H4O8F24Y
  4591 Y(III)O8(-) (CYSFAC10)C20H4O8F24Y
  4592 Yttrium(II) sulfide (Geo)SY
  4593 Yttrium(II) sulfideSY
  4594 YO6N3 (BUTKEG) (Geo)C23H24N3O6S3Y
  4595 YO6N3 (BUTKEG)C23H24N3O6S3Y
  4596 Y(III)O9 (CEXFAM) (Geo)C6H18N3O12S3Y
  4597 Y(III)O9 (CEXFAM)C6H18N3O12S3Y
  4598 Y(III)N6(3-) (KAKQES) (Geo) C6N6S6Y
  4599 Y(III)N6(3-) (KAKQES)C6N6S6Y
  4600 Yttrium(I) monochloride (Geo)ClY
  4601 Yttrium(I) chlorideClY
  4602 Yttrium(III) oxide chloride (Geo)OClY
  4603 Yttrium(III) oxide chlorideOClY
  4604 Y(Cp)2O2Cl (AGUVUT) (Geo)C28H30O2ClY
  4605 Y(Cp)2O2Cl (AGUVUT)C28H30O2ClY
  4606 Y(III)O7Cl(2+) (FIZKOO) (Geo)C12H28O8ClY
  4607 Y(III)O7Cl(2+) (FIZKOO)C12H28O8ClY
  4608 Yttrium(III) trichloride (Geo)Cl3Y


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 CHARGE=-3 PM7
Y(III)N6(3-) (KAKQES)
 <Y-N> <N-C><> <C-S><><> GR=CCDC
  Y     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  N     2.32226700 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.15106100 +1  179.9378353 +1  180.0000000 +0     2     1     0
  S     1.61686200 +1  179.9958314 +1  108.8596079 +1     3     2     1
  N     2.49107717 +1   90.4145402 +1   62.1064499 +1     1     2     3
  C     1.16969921 +1  179.3882126 +1   54.6387237 +1     5     1     2
  S     1.63369570 +1  179.8162081 +1  -63.1184702 +1     6     5     3
  N     2.48901683 +1   89.5902854 +1  179.8682597 +1     1     5     2
  C     1.16968041 +1  179.9524339 +1   20.4683646 +1     8     1     5
  S     1.63393187 +1  179.9881709 +1  -29.1804175 +1     9     8     5
  N     2.49108310 +1   90.4324932 +1  179.7959368 +1     1     2     5
  C     1.16954293 +1  179.6705195 +1   39.3650981 +1    11     1     2
  S     1.63365179 +1  179.8021575 +1  123.2385525 +1    12    11     8
  N     2.49113821 +1   90.4573865 +1   90.1437954 +1     1     2    11
  C     1.16967663 +1  179.4119829 +1  -25.5903821 +1    14     1     2
  S     1.63370297 +1  179.9920579 +1   13.1326947 +1    15    14    11
  N     2.49095121 +1   90.5786993 +1  179.9947324 +1     1     2    14
  C     1.16979019 +1  179.3347674 +1    2.9141689 +1    17     1     2
  S     1.63366922 +1  179.9113307 +1  -20.5719775 +1    18    17    11