Accuracy

Lu_(HELGUA) r   7177 Lutetium complex, CCDC: HELGUA (Geo)

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    #  Species Formula
  7167 Lu(III)(H2O)9(3+) (BUVVUJ)H18O9Lu
  7168 Lutetium complex, CCDC: BUVVUJ (Geo)H18O9Lu
  7169 Lutetium complex, CCDC: PUDTIR (Geo)C28H36N5O9Lu
  7170 Lutetium complex, CCDC: EFIZEY (Geo)C15H11N6O9Lu
  7171 Lutetium complex, CCDC: RADRIX (Geo)C20H16N7O9Lu
  7172 Lutetium complex, CCDC: RADROD (Geo)C24H16N7O9Lu
  7173 Lutetium complex, CCDC: EFIZOI (Geo)C17H17N6O10Lu
  7174 Lutetium complex, CCDC: POHDIZ (Geo)C2H7N4O11Lu
  7175 Lu(III)O8(-) (OGEYEE) (Geo)C8H12O12Lu
  7176 Lu(III)O8(-) (OGEYEE)C8H12O12Lu
  7177 Lutetium complex, CCDC: HELGUA (Geo) H6N3O12Lu
  7178 Lutetium complex, CCDC: XONZOP (Geo)C46H48NO4Si2Lu
  7179 Lutetium complex, CCDC: SUDDOK (Geo)C14H26O12S2Lu
  7180 Lutetium complex, CCDC: FEWKEX (Geo)C36H30N3O12S3Lu
  7181 Lu(III)N6(3-) (PUKRUI) (Geo)C6N6S6Lu
  7182 Lu(III)N6(3-) (PUKRUI)C6N6S6Lu
  7183 Lu(Cp)2N2Cl (BIVBIR)a (Geo)C18H28N2ClLu
  7184 Lu(Cp)2N2Cl (BIVBIR)aC18H28N2ClLu
  7185 Lu(III)(Cp)2OCl (FATGIQ10) (Geo)C14H18OClLu
  7186 Lu(III)(Cp)2OCl (FATGIQ10)C14H18OClLu
  7187 Lu(Cp)2O2Cl (AXOMUV) (Geo)C28H30O2ClLu


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7 SPARKLES
Lutetium complex, CCDC: HELGUA
 <Lu-O2> <Lu-O3> <> <Lu-O4> <> <> <Lu-O5> <> <> <Lu-O6> <> <> <Lu-O7> GR=CCDC
 Lu     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.22060002 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.30184590 +1   66.7685654 +1    0.0000000 +0     1     2     0
  O     2.32220028 +1  108.5859655 +1  -53.0794422 +1     1     2     3
  O     2.34769952 +1  173.6178172 +1  -77.2915226 +1     1     2     3
  O     2.36278170 +1  124.6134472 +1  127.9277376 +1     1     2     3
  O     2.39002954 +1   65.4139258 +1 -101.5964588 +1     1     2     3
  O     2.16219826 +1   56.5401576 +1   -1.6896697 +1     6     1     2
  O     2.18674527 +1   62.0831958 +1  -82.6233057 +1     7     1     2
  O     2.18258332 +1   64.9396166 +1  158.7273160 +1     3     1     2
  N     1.26905849 +1   88.3220894 +1    2.3480355 +1     6     1     2
  N     1.26257574 +1   30.4238279 +1  -77.3706600 +1    10     3     1
  N     1.26345655 +1   59.5387012 +1 -116.6374879 +1     7     1     2
  O     1.25241181 +1  120.2160972 +1  174.2821851 +1    12    10     3
  O     1.21139751 +1  122.2982014 +1  173.5014789 +1    11     6     1
  O     1.25990419 +1  119.5374302 +1  -88.7143975 +1    13     7     1
  H     0.98547507 +1  130.5570511 +1   51.0735574 +1     2     1     3
  H     0.98981628 +1  126.8822821 +1 -131.2739371 +1     2     1     3
  H     0.98994307 +1  114.7573744 +1  149.7278058 +1     5     1     2
  H     0.98754821 +1  117.4321851 +1  -90.9554369 +1     5     1     2
  H     0.98331176 +1  123.0809070 +1  141.6353047 +1     4     1     2
  H     0.98084676 +1  130.3150100 +1  -62.4151265 +1     4     1     2