Accuracy

Eu_(LEJTAV) r   6788 Europium complex, CCDC: LEJTAV (Geo)

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    #  Species Formula
  6778 Europium complex, CCDC: KELNOE (Geo)C8H13O14Eu
  6779 Europium complex, CCDC: BEKWUJ (Geo)C10H20N3O14Eu
  6780 Europium complex, CCDC: PITCUQ (Geo)C6H13N12O14Eu
  6781 Europium complex, CCDC: BAPXAR (Geo)C12H12O15Eu
  6782 Europium complex, CCDC: DOFXIF (Geo)C12H12O15Eu
  6783 Europium complex, CCDC: PHASEU (Geo)N5O15Eu
  6784 Europium complex, CCDC: XIHQIO (Geo)C30H42N7O15Eu
  6785 Europium complex, CCDC: WELBUK (Geo)H2N5O16Eu
  6786 Europium complex, CCDC: QALFEO (Geo)C12H30N3O18Eu
  6787 Europium complex, CCDC: SUXXIS (Geo)N6O18Eu
  6788 Europium complex, CCDC: LEJTAV (Geo) C12H16N6O20Eu
  6789 Europium complex, CCDC: QIQHAZ (Geo)C23H21N10O25Eu
  6790 Europium complex, CCDC: KAKPAN (Geo)C36H31N6O8F9Eu
  6791 Europium complex, CCDC: MASKAS (Geo)C44H32O8F12Eu
  6792 Europium complex, CCDC: KAFDOK (Geo)C21H17O9F18Eu
  6793 Europium complex, CCDC: GEBYAN (Geo)C38H36N3O12P2Eu
  6794 Europium complex, CCDC: MIHNOG (Geo)C51H30O8F21P2Eu
  6795 Europium complex, CCDC: QUBWUF (Geo)C12H32N3O23P4Eu
  6796 Europium complex, CCDC: XILGII (Geo)C29H46N6O7F3SEu
  6797 Europium complex, CCDC: LOWBEE (Geo)C33H40N4O10F3SEu
  6798 Europium complex, CCDC: QALFOY (Geo)C14H26O12S2Eu


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 CHARGE=1.0
Europium complex, CCDC: LEJTAV
 <Eu-O2> <Eu-O3> <> <Eu-O4> <> <> <Eu-O5> <> <> <Eu-O6> <> <> <Eu-O7> GR=CCDC
 Eu     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.32670000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.37089938 +1  155.0286582 +1    0.0000000 +0     1     2     0
  O     2.42299966 +1   89.6578470 +1   81.4262656 +1     1     2     3
  O     2.43750033 +1  101.4795108 +1 -133.8836458 +1     1     2     3
  O     2.44619999 +1  134.5289633 +1  147.5603340 +1     1     2     3
  O     2.44819978 +1   88.1189747 +1  -67.9486893 +1     1     2     3
  O     3.45855974 +1   75.5762435 +1  158.8871596 +1     1     2     3
  O     3.34540309 +1   92.0481506 +1    7.0993701 +1     1     2     3
  C     1.26073788 +1  179.4303434 +1   87.2650971 +1     2     1     3
  C     1.43053169 +1  122.2471499 +1    6.1308112 +1    10     2     1
  C     1.39772159 +1  119.9554876 +1  178.5334718 +1    11    10     2
  C     1.39560526 +1  119.8547919 +1   -1.2241298 +1    12    11    10
  C     1.40092402 +1  121.7898322 +1    0.4541289 +1    13    12    11
  C     1.38678754 +1  119.0599169 +1    1.3396330 +1    14    13    12
  O     2.31168356 +1   94.5771169 +1    3.7647294 +1    11    10     2
  O     2.78493679 +1   98.7837996 +1   75.0271463 +1     3     1     2
  N     1.23365619 +1   32.6996635 +1 -169.8067191 +1    16    11    10
  N     1.46000284 +1  119.2562569 +1 -179.4815789 +1    13    12    11
  O     1.21527140 +1  117.3624085 +1    2.1289965 +1    19    13    12
  O     1.21589115 +1  117.2407509 +1 -178.0845348 +1    19    13    12
  N     1.22977341 +1   75.4059019 +1  136.0638689 +1    17     3     1
  O     2.86354118 +1  101.6484543 +1  -62.3436319 +1     3     1     2
  O     2.29121210 +1  137.3991600 +1  149.2077948 +1    15    14    13
  C     1.26308405 +1  179.9938430 +1  161.7906831 +1     3     1     2
  C     1.42661061 +1  121.6165368 +1  111.0375616 +1    25     3     1
  C     1.38747109 +1  121.0851309 +1 -172.8408961 +1    26    25     3
  C     1.40066890 +1  118.9059679 +1   -0.3045832 +1    27    26    25
  C     1.39889083 +1  122.0435060 +1   -1.3054680 +1    28    27    26
  C     1.38890866 +1  119.0034852 +1    0.8969227 +1    29    28    27
  N     1.23423397 +1   72.9163316 +1 -132.1480576 +1    23     3     1
  O     1.21255725 +1  121.6150210 +1 -179.4834201 +1    18    16    11
  N     1.23325111 +1   33.6969940 +1   63.0312339 +1    24    15    14
  N     1.46083333 +1  118.9492782 +1  178.9173447 +1    28    27    26
  O     1.21582938 +1  117.2956544 +1  178.2822967 +1    34    28    27
  O     1.21574700 +1  117.2445966 +1   -2.0934474 +1    34    28    27
  O     1.21266869 +1  123.2023195 +1 -133.6631105 +1    22    17     3
  O     1.20987711 +1  123.2681309 +1  131.2554427 +1    31    23     3
  O     1.21064870 +1  122.9311806 +1 -179.4740474 +1    33    24    15
  H     0.98181592 +1  119.0935409 +1 -166.8153764 +1     6     1     2
  H     0.97952691 +1  128.5875568 +1  -21.2849066 +1     6     1     2
  H     0.99986630 +1  118.5264316 +1   -9.6088901 +1     4     1     2
  H     0.99019470 +1  124.8086911 +1 -151.1087188 +1     4     1     2
  H     0.96549167 +1  129.7007565 +1  -19.6889091 +1     8     1     2
  H     0.96083257 +1  126.1187015 +1  159.2906119 +1     8     1     2
  H     0.98098653 +1  131.3743336 +1  -23.0445159 +1     7     1     2
  H     1.00099338 +1  121.2660977 +1  152.6497595 +1     7     1     2
  H     0.96004362 +1  121.7596372 +1  109.3044100 +1     9     1     2
  H     0.96017484 +1  121.6003079 +1 -111.5643285 +1     9     1     2
  H     0.98602628 +1  121.6610081 +1   42.0609328 +1     5     1     2
  H     0.97634240 +1  133.3525652 +1 -143.3925163 +1     5     1     2
  H     1.11115425 +1  120.3017276 +1  179.0758152 +1    12    11    10
  H     1.10815884 +1  120.0724099 +1 -179.5254418 +1    14    13    12
  H     1.10752793 +1  121.0316350 +1  179.6944345 +1    27    26    25
  H     1.10747836 +1  120.1466442 +1 -179.0868432 +1    29    28    27