Accuracy

Er_(TOKTOC) r   7055 Erbium complex, CCDC: TOKTOC (Geo)

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    #  Species Formula
  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
  7051 Erbium complex, CCDC: HAGSAJ (Geo)C48H50O16Er2
  7052 Erbium complex, CCDC: VUSHEW (Geo)C12H44N4O16Er2
  7053 Erbium complex, CCDC: DAFKOK (Geo)C24H36N4O22Er2
  7054 Erbium complex, CCDC: FOSXUG (Geo)C20H20Cl2Er2
  7055 Erbium complex, CCDC: TOKTOC (Geo) C36H52Cl2Er2
  7056 Erbium complex, CCDC: PIDCAG (Geo)C40H52Cl2Er2
  7057 Erbium complex, CCDC: YADWUV (Geo)C28H36O2Cl2Er2
  7058 Erbium complex, CCDC: DUFCUC10 (Geo)C20H20Br2Er2
  7059 Erbium complex, CCDC: JAQFEM (Geo)C44H84Si8Br2Er2
  7060 Thulium complex, CCDC: TUTXOV (Geo)C18H31N9Tm
  7061 Thulium complex, CCDC: VEQFUS (Geo)C27H27N4O3Tm
  7062 Thulium complex, CCDC: MEDNAK (Geo)C26H30N8O6Tm
  7063 Thulium complex, CCDC: BAGBIV (Geo)C20H18N5O8Tm
  7064 Thulium complex, CCDC: ZZZARJ01 (Geo)H18O9Tm
  7065 Thulium complex, CCDC: KITHAW (Geo)C8H26O9Tm


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: TOKTOC
 <Er-Er> <Er-Cl> <> <Er-C> GR=CCDC
 Er     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Er     4.01811500 +1    0.0000000 +0    0.0000000 +0     1     0     0
 Cl     2.66580000 +1   59.1517968 +1    0.0000000 +0     1     2     0
  C     2.60277600 +1  119.1175518 +1   88.7889991 +1     1     2     3
  C     1.47402175 +1  105.3813315 +1    1.8681501 +1     4     1     2
  C     1.36735121 +1  109.7938282 +1  111.2396889 +1     5     4     1
  C     2.34562695 +1   72.6380501 +1  172.7898319 +1     1     2     4
  C     1.49588220 +1  110.8632823 +1  -85.3116768 +1     7     1     2
  C     1.35718234 +1  110.5787321 +1 -119.1085871 +1     8     7     1
  C     1.45323624 +1  108.5589379 +1   -3.1877017 +1     9     8     7
  C     1.36563162 +1  109.0302820 +1   -0.6487014 +1    10     9     8
 Cl     3.36678719 +1   54.7062315 +1 -168.2837851 +1     2     1     3
  C     2.28909660 +1  108.6444033 +1 -113.9684037 +1     2     1    12
  C     1.50178947 +1  109.1310500 +1   64.4243729 +1    13     2     1
  C     1.35716623 +1  110.3993504 +1 -123.1594591 +1    14    13     2
  C     1.45441042 +1  108.6822650 +1   -2.3946056 +1    15    14    13
  C     1.50573235 +1  119.6086469 +1 -116.7091669 +1    13     2    14
  C     2.29362675 +1   79.5678069 +1 -167.1342355 +1     2     1    13
  C     1.49785380 +1  112.0171023 +1   76.7644694 +1    18     2     1
  C     1.35713497 +1  110.5760110 +1  121.8945190 +1    19    18     2
  C     1.45309035 +1  108.5892532 +1    2.5164631 +1    20    19    18
  C     1.36546254 +1  109.1178273 +1    0.8471314 +1    21    20    19
  C     1.49396198 +1  128.8540443 +1 -176.4109982 +1     6     5     4
  C     1.54032280 +1  108.3141459 +1  112.6299855 +1    23     6     5
  C     1.53751875 +1  111.6048507 +1 -120.2898930 +1    23     6    24
  C     1.54081323 +1  109.4802721 +1 -120.1297182 +1    23     6    25
  C     1.50362449 +1  122.5071116 +1 -169.1133089 +1    11    10     9
  C     1.53495934 +1  114.4168383 +1  168.6696002 +1    27    11    10
  C     1.54497729 +1  107.4999677 +1 -118.7015121 +1    27    11    28
  C     1.54141159 +1  109.4821503 +1 -118.4660009 +1    27    11    29
  C     1.50340985 +1  127.1848300 +1  -73.4393342 +1    17    13     2
  C     1.53707441 +1  110.3719483 +1  139.3529238 +1    31    17    13
  C     1.54569580 +1  106.3403286 +1  118.1916278 +1    31    17    32
  C     1.53987156 +1  115.0330404 +1  119.3899455 +1    31    17    33
  C     1.50464502 +1  122.3526564 +1  170.2732523 +1    22    21    20
  C     1.53402050 +1  114.8615538 +1 -169.4903124 +1    35    22    21
  C     1.54417083 +1  107.4540520 +1  118.8521330 +1    35    22    36
  C     1.54232340 +1  109.2335193 +1  118.3198026 +1    35    22    37
  H     2.23491303 +1  131.5160270 +1  179.6163315 +1     6     5    23
  H     2.24354979 +1  102.4009937 +1  134.3399353 +1     4     1     5
  H     1.07532195 +1  105.8744103 +1  103.0484560 +1     4     1    40
  H     1.06841804 +1  123.3063223 +1  177.0311364 +1     5     4     6
  H     1.09621999 +1  111.3756752 +1   57.9942130 +1    24    23     6
  H     1.09440293 +1  111.0667469 +1 -118.3089707 +1    24    23    43
  H     1.09358820 +1  111.4641084 +1 -120.5990363 +1    24    23    44
  H     1.09531708 +1  111.5210228 +1   61.7596718 +1    25    23     6
  H     1.09573624 +1  111.0646927 +1 -119.4346741 +1    25    23    46
  H     1.09465596 +1  111.3353164 +1 -120.6765053 +1    25    23    47
  H     1.09599146 +1  110.4966281 +1   57.4568653 +1    26    23     6
  H     1.09463775 +1  111.2173206 +1 -119.2775613 +1    26    23    49
  H     1.09465991 +1  111.0681334 +1 -120.4804926 +1    26    23    50
  H     1.09438468 +1  110.5571463 +1  123.5813479 +1     7     1     8
  H     1.07028350 +1  124.1486529 +1 -178.2480675 +1     8     7     9
  H     1.07275144 +1  127.9024084 +1 -177.9788888 +1     9     8    10
  H     1.07096847 +1  123.0257980 +1 -176.8256005 +1    10     9    11
  H     1.08855872 +1  113.7420014 +1   81.5025056 +1    28    27    11
  H     1.09744962 +1  111.4978107 +1 -124.0122212 +1    28    27    56
  H     1.09915521 +1  110.9023219 +1 -117.4963920 +1    28    27    57
  H     1.09705102 +1  110.5134969 +1   58.6219342 +1    29    27    11
  H     1.09507834 +1  111.7854606 +1 -119.3070761 +1    29    27    59
  H     1.09511141 +1  111.4670497 +1 -120.6103166 +1    29    27    60
  H     1.09677233 +1  111.0163439 +1   56.3105760 +1    30    27    11
  H     1.08867528 +1  112.6293845 +1 -121.4298549 +1    30    27    62
  H     1.09764387 +1  110.5584573 +1 -120.2850909 +1    30    27    63
  H     1.09472666 +1  109.3754894 +1 -123.5795827 +1    13     2    17
  H     1.06881563 +1  123.1780844 +1 -176.1540924 +1    14    13    15
  H     1.07444818 +1  128.0786488 +1 -178.9873408 +1    15    14    16
  H     1.07113810 +1  122.9060972 +1 -177.9190988 +1    16    15    14
  H     1.09539897 +1  111.8424187 +1   57.1856349 +1    32    31    17
  H     1.09524369 +1  111.8676104 +1 -120.3694635 +1    32    31    69
  H     1.09617098 +1  111.3396180 +1 -119.7345178 +1    32    31    70
  H     1.09442114 +1  111.1569451 +1   60.2171539 +1    33    31    17
  H     1.09720451 +1  111.1229139 +1 -119.2133443 +1    33    31    72
  H     1.09462077 +1  111.4081941 +1 -119.9797788 +1    33    31    73
  H     1.09142328 +1  112.0556681 +1   75.4274370 +1    34    31    17
  H     1.09014315 +1  112.0024673 +1 -126.5113576 +1    34    31    75
  H     1.10203161 +1  109.6101542 +1 -117.5167588 +1    34    31    76
  H     1.10170357 +1  109.6271898 +1 -122.1839029 +1    18     2    19
  H     1.06965579 +1  124.1343357 +1  176.7334518 +1    19    18    20
  H     1.07287308 +1  127.9417760 +1  177.8569703 +1    20    19    21
  H     1.07097203 +1  122.9727580 +1  176.7147225 +1    21    20    22
  H     1.10267747 +1  111.5367734 +1   47.6213747 +1    36    35    22
  H     1.08506078 +1  114.3667663 +1 -124.3332297 +1    36    35    82
  H     1.09987476 +1  110.8371098 +1 -119.3472503 +1    36    35    83
  H     1.09459930 +1  111.9257463 +1   61.3090839 +1    37    35    22
  H     1.09994125 +1  110.4056669 +1 -119.3221887 +1    37    35    85
  H     1.09486409 +1  111.5865343 +1 -119.8946455 +1    37    35    86
  H     1.08803551 +1  112.7701390 +1   65.0277038 +1    38    35    22
  H     1.09680482 +1  111.0050527 +1 -121.3916390 +1    38    35    88
  H     1.09757261 +1  110.5367786 +1 -118.0817000 +1    38    35    89
  C     1.06972802 +1   33.0066148 +1   -0.9389759 +1    39     6     5
  C     1.06846402 +1   33.0589454 +1 -112.2954297 +1    40     4     1