Accuracy

Er_(VEQFOM) r   7007 Erbium complex, CCDC: VEQFOM (Geo)

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    #  Species Formula
  6997 Holmium complex, CCDC: IDOZIK (Geo)C54H58N4O12Ho2
  6998 Holmium complex, CCDC: NIHRIF (Geo)C42H34N8O14Ho2
  6999 Holmium complex, CCDC: KAVLOI (Geo)C12H44N4O16Ho2
  7000 Holmium complex, CCDC: COZHEE (Geo)C36H32N6O16Ho2
  7001 Erbium complex, CCDC: XOXXAJ (Geo)C23H37N2Er
  7002 Erbium complex, CCDC: DIJQIW (Geo)C33H47N8Er
  7003 Erbium complex, CCDC: DIJQAO (Geo)C44H77N8Er
  7004 Erbium complex, CCDC: YEDSIJ10 (Geo)C19H23OEr
  7005 Erbium complex, CCDC: YEGFEV (Geo)C41H73N6O2Er
  7006 Erbium complex, CCDC: ZADWUW (Geo)C30H39O3Er
  7007 Erbium complex, CCDC: VEQFOM (Geo) C27H27N4O3Er
  7008 Erbium complex, CCDC: TUMJEQ (Geo)C53H53N6O4Er
  7009 Erbium complex, CCDC: UFIRIK (Geo)C48H66N8O5Er
  7010 Erbium complex, CCDC: TMHDER (Geo)C33H57O6Er
  7011 Erbium complex, CCDC: XEWVOK (Geo)C10H20N2O6Er
  7012 Erbium complex, CCDC: XEWWUR (Geo)C10H20N2O6Er
  7013 Erbium complex, CCDC: BAGBER (Geo)C20H18N5O8Er
  7014 Erbium complex, CCDC: AERETS02 (Geo)H18O9Er
  7015 Erbium complex, CCDC: GINRIE (Geo)C8H26O9Er
  7016 Erbium complex, CCDC: KITGUP (Geo)C8H26O9Er
  7017 Erbium complex, CCDC: HANCOO (Geo)C10H28O9Er


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
Erbium complex, CCDC: VEQFOM
 <Er-O2> <Er-O3> <> <Er-O4> <> <> <Er-N5> <> <> <Er-N6> <> <> <Er-N7> GR=CCDC
 Er     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.18800000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.18840003 +1  111.9348503 +1    0.0000000 +0     1     2     0
  O     2.18910000 +1   94.1013677 +1  101.9599899 +1     1     2     3
  N     2.45378725 +1   69.4541550 +1  -83.4485036 +1     1     2     3
  N     2.45459999 +1   94.6387075 +1  172.0178763 +1     1     2     3
  N     2.71590002 +1  126.6565452 +1 -122.6323462 +1     1     2     3
  N     3.30528553 +1  167.1257855 +1   -7.0364259 +1     1     2     3
  C     1.27069252 +1  149.0762224 +1   76.1774236 +1     4     1     2
  C     1.43137638 +1  120.2126349 +1 -166.0557074 +1     9     4     1
  C     1.36598143 +1  119.3125525 +1  178.6722168 +1    10     9     4
  C     1.42068339 +1  120.9224040 +1    0.2065942 +1    11    10     9
  C     1.37162161 +1  120.1734994 +1    0.6483298 +1    12    11    10
  C     1.41708900 +1  121.2979107 +1   -0.3568282 +1    13    12    11
  C     1.32541495 +1  132.1050577 +1  -82.8212159 +1     6     1     2
  C     1.48254039 +1  114.0174365 +1   99.5507359 +1     6     1     2
  C     1.50949121 +1  109.2833162 +1  -83.4992010 +1     7     1     2
  H     1.08664877 +1  117.5840425 +1   -1.1474011 +1    10     9     4
  H     1.09119717 +1  120.6801075 +1 -179.7356651 +1    11    10     9
  H     1.08495390 +1  118.8802510 +1 -179.4559509 +1    12    11    10
  H     1.09045660 +1  119.9605689 +1  179.7692628 +1    13    12    11
  H     1.10962995 +1  119.8102496 +1  176.9451624 +1    15     6     1
  H     1.10935372 +1  114.1864891 +1  179.9044222 +1    16     6     1
  H     1.11259877 +1  108.6250438 +1  -62.4221207 +1    16     6     1
  H     1.10632774 +1  112.4577122 +1  158.8698402 +1    17     7     1
  H     1.11435980 +1  108.6218995 +1  -83.2915582 +1    17     7     1
  C     1.27315447 +1  150.3127061 +1   74.4401241 +1     2     1     3
  C     1.42938414 +1  120.2402299 +1 -172.9731924 +1    27     2     1
  C     1.36743646 +1  119.2529776 +1  179.6769558 +1    28    27     2
  C     1.41939521 +1  120.9206313 +1   -0.0827292 +1    29    28    27
  C     1.37264071 +1  120.1546596 +1    0.2677226 +1    30    29    28
  C     1.41593792 +1  121.2649157 +1    0.0507579 +1    31    30    29
  C     1.32312806 +1  132.9730301 +1    6.0564074 +1     5     1     2
  C     1.28613258 +1  160.6081311 +1  126.2820247 +1     3     1     2
  C     1.42457785 +1  118.3216691 +1 -116.3434791 +1    34     3     1
  C     1.37470647 +1  119.7159155 +1 -179.7692511 +1    35    34     3
  C     1.40765154 +1  120.8026162 +1    0.2435067 +1    36    35    34
  C     1.38214723 +1  119.7685676 +1    0.3188026 +1    37    36    35
  C     1.40336332 +1  121.3453981 +1   -0.3847377 +1    38    37    36
  C     1.29127188 +1  123.9976907 +1    2.3066641 +1     8     1     2
  C     1.51575755 +1  108.0892000 +1   32.7928665 +1     7     1     2
  C     1.48355279 +1  112.9790970 +1 -174.4146917 +1     5     1     2
  C     1.51730136 +1  119.8498323 +1  152.9915335 +1     7     1     2
  C     1.45184402 +1  104.7456735 +1 -144.0544951 +1     8     1     2
  H     1.10850564 +1  114.2512514 +1 -178.9566100 +1    42     5     1
  H     1.11552250 +1  108.3179335 +1  -61.2121734 +1    42     5     1
  H     1.10674847 +1  112.5921184 +1  161.3366668 +1    41     7     1
  H     1.11205863 +1  109.7013717 +1  -80.8707435 +1    41     7     1
  H     1.11026217 +1  115.2386129 +1  170.8854635 +1    44     8     1
  H     1.11371719 +1  107.5246606 +1  -70.6899905 +1    44     8     1
  H     1.10869331 +1  110.9633807 +1  173.0064221 +1    43     7     1
  H     1.11493086 +1  107.5288269 +1  -70.3034637 +1    43     7     1
  H     1.10314338 +1  123.9518829 +1 -151.1846572 +1    40     8     1
  H     1.09016621 +1  119.6144007 +1 -179.9108325 +1    38    37    36
  H     1.08377482 +1  119.6281823 +1 -179.5585508 +1    37    36    35
  H     1.09002581 +1  120.2218669 +1 -179.6742052 +1    36    35    34
  H     1.08422162 +1  118.0489792 +1    0.4600098 +1    35    34     3
  H     1.10947430 +1  120.0306326 +1  176.6933057 +1    33     5     1
  H     1.09057916 +1  119.9336022 +1 -179.8756955 +1    31    30    29
  H     1.08515982 +1  118.9386415 +1 -179.6142111 +1    30    29    28
  H     1.09124384 +1  120.5999977 +1 -179.9411126 +1    29    28    27
  H     1.08641110 +1  117.7042690 +1   -0.2356376 +1    28    27     2