Accuracy

Er_(BOBWAQ) r   7040 Erbium complex, CCDC: BOBWAQ (Geo)

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    #  Species Formula
  7030 Erbium complex, CCDC: XAMREI (Geo)C26H36NSi3Er
  7031 Erbium complex, CCDC: EHEKUX (Geo)C20H49O2Si3Er
  7032 Erbium complex, CCDC: WEFVIM (Geo)C81H63N6O2P2Er
  7033 Erbium complex, CCDC: VOSNOG (Geo)C40H36N3O14P2Er
  7034 Erbium complex, CCDC: DOGKEP (Geo)C36H76N7O20P2Er
  7035 Erbium complex, CCDC: IFOSIF (Geo)C41H49N2Si2P2Er
  7036 Erbium complex, CCDC: NIVQUE (Geo)C72H60N4O8P4Er
  7037 Erbium complex, CCDC: GAKYOG (Geo)C14H26O12S2Er
  7038 Erbium complex, CCDC: DIYNII (Geo)C20H26O12S2Er
  7039 Erbium complex, CCDC: DIBTAJ (Geo)C36H30N3O12S3Er
  7040 Erbium complex, CCDC: BOBWAQ (Geo) C17H29O3Cl2Er
  7041 Erbium complex, CCDC: LOKDAQ (Geo)C18H31O3Cl2Er
  7042 Erbium complex, CCDC: POHDEV (Geo)C24H35O3Cl2Er
  7043 Erbium complex, CCDC: ZUFSAU (Geo)C24H22N4O6Cl4Er
  7044 Erbium complex, CCDC: MALZOO01 (Geo)C34H30NP2Se2Er
  7045 Erbium complex, CCDC: NUFGIE (Geo)C30H39O3Se3Er
  7046 Erbium complex, CCDC: PESQUZ (Geo)C26H50OSi4IEr
  7047 Erbium complex, CCDC: GERQID (Geo)C44H54Er2
  7048 Erbium complex, CCDC: FEVGUI (Geo)C30H40N2Er2
  7049 Erbium complex, CCDC: DIDCAU (Geo)C24H38O14Er2
  7050 Erbium complex, CCDC: TACERB01 (Geo)C12H26O16Er2


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: BOBWAQ
 <Er-O2> <Er-O3> <> <Er-O4> GR=CCDC
 Er     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.35050049 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.45240028 +1   99.2376300 +1    0.0000000 +0     1     2     0
  O     2.36509965 +1  179.9974160 +1   17.3235182 +1     1     2     3
 Cl     3.26512332 +1   79.4712890 +1  -71.5677657 +1     1     2     3
 Cl     3.23321386 +1   80.5184293 +1   72.5484854 +1     1     2     3
  C     3.55915780 +1  113.4698228 +1 -176.5901446 +1     1     2     3
  C     1.41219492 +1   79.4361432 +1   47.2378671 +1     7     1     2
  C     1.41063626 +1  108.0208727 +1  -76.4410101 +1     8     7     1
  C     1.41243244 +1  107.9787668 +1   -0.6327858 +1     9     8     7
  C     1.41423236 +1   81.2913238 +1  -62.9932863 +1     7     1     2
  C     1.48366246 +1  126.0495324 +1  -84.6186285 +1     2     1     3
  C     1.51731485 +1  107.8730304 +1 -176.8673672 +1    12     2     1
  C     1.53540216 +1  105.2302032 +1   13.0974967 +1    13    12     2
  C     1.51466817 +1  104.7616431 +1  -24.7909919 +1    14    13    12
  C     1.47331860 +1  126.8339201 +1  -76.7478289 +1     3     1     2
  C     1.52090759 +1  108.0842057 +1  178.4683849 +1    16     3     1
  C     1.53436063 +1  104.8968702 +1   12.8208533 +1    17    16     3
  C     1.47170299 +1  124.7245550 +1   95.1468379 +1     3     1     2
  C     1.47632169 +1  125.1549697 +1  -77.2336306 +1     4     1     2
  C     1.51678633 +1  107.5300693 +1  173.8023350 +1    20     4     1
  C     1.53505783 +1  104.3671440 +1   22.8665571 +1    21    20     4
  C     1.48208068 +1  126.3302620 +1  105.4063404 +1     4     1     2
  H     1.10481083 +1  103.5803039 +1  -55.9161217 +1    12     2     1
  H     1.10371984 +1  104.1293999 +1   61.2794612 +1    12     2     1
  H     1.10561789 +1  111.8177668 +1 -107.8131419 +1    13    12     2
  H     1.10647513 +1  111.8244624 +1  134.0476860 +1    13    12     2
  H     1.10482032 +1  111.7985509 +1 -146.2062082 +1    14    13    12
  H     1.10854314 +1  110.8671533 +1   95.9485416 +1    14    13    12
  H     1.10431086 +1  114.4733075 +1  -87.0820212 +1    15    14    13
  H     1.10319002 +1  114.2506740 +1  142.1484653 +1    15    14    13
  H     1.10267724 +1  104.2015882 +1  -60.1571465 +1    16     3     1
  H     1.10495523 +1  104.7597726 +1   56.8890038 +1    16     3     1
  H     1.10660839 +1  111.6013035 +1 -107.5173958 +1    17    16     3
  H     1.10453579 +1  111.9248270 +1  134.2516984 +1    17    16     3
  H     1.10530229 +1  111.9993617 +1 -146.4995494 +1    18    17    16
  H     1.10461057 +1  111.2248721 +1   95.2217721 +1    18    17    16
  H     1.10683929 +1  105.1888923 +1  -74.2430679 +1    19     3     1
  H     1.10057826 +1  104.7317432 +1   43.3046163 +1    19     3     1
  H     1.10607883 +1  104.0594234 +1  -65.7010290 +1    20     4     1
  H     1.10215466 +1  103.9540352 +1   52.5606872 +1    20     4     1
  H     1.10550280 +1  112.1719210 +1  -97.5423801 +1    21    20     4
  H     1.10595436 +1  112.0836757 +1  143.7912245 +1    21    20     4
  H     1.10481073 +1  111.9185359 +1 -149.9503639 +1    22    21    20
  H     1.10937456 +1  110.9344521 +1   92.3426467 +1    22    21    20
  H     1.10284740 +1  103.9763151 +1  -71.1346383 +1    23     4     1
  H     1.11017923 +1  103.9604016 +1   47.3296380 +1    23     4     1
  H     1.06287194 +1  112.4414206 +1  171.4582354 +1     7     1     2
  H     1.06475808 +1  125.9440478 +1  106.9593582 +1     8     7     1
  H     1.06396355 +1  126.0143805 +1 -176.0960155 +1     9     8     7
  H     1.06466297 +1  125.8810937 +1 -175.8951365 +1    10     9     8
  H     1.06398503 +1  126.2290830 +1 -109.0815968 +1    11     7     1