Accuracy

Y(Cp)2O2Cl (AGUVUT) r   4604 Y(Cp)2O2Cl (AGUVUT) (Geo)

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    #  Species Formula
  4594 YO6N3 (BUTKEG) (Geo)C23H24N3O6S3Y
  4595 YO6N3 (BUTKEG)C23H24N3O6S3Y
  4596 Y(III)O9 (CEXFAM) (Geo)C6H18N3O12S3Y
  4597 Y(III)O9 (CEXFAM)C6H18N3O12S3Y
  4598 Y(III)N6(3-) (KAKQES) (Geo)C6N6S6Y
  4599 Y(III)N6(3-) (KAKQES)C6N6S6Y
  4600 Yttrium(I) monochloride (Geo)ClY
  4601 Yttrium(I) chlorideClY
  4602 Yttrium(III) oxide chloride (Geo)OClY
  4603 Yttrium(III) oxide chlorideOClY
  4604 Y(Cp)2O2Cl (AGUVUT) (Geo) C28H30O2ClY
  4605 Y(Cp)2O2Cl (AGUVUT)C28H30O2ClY
  4606 Y(III)O7Cl(2+) (FIZKOO) (Geo)C12H28O8ClY
  4607 Y(III)O7Cl(2+) (FIZKOO)C12H28O8ClY
  4608 Yttrium(III) trichloride (Geo)Cl3Y
  4609 Yttrium(III) trichlorideCl3Y
  4610 Y(III)N4Cl3 (YIQMUG) (Geo)C20H20N4Cl3Y
  4611 Y(III)N4Cl3 (YIQMUG)C20H20N4Cl3Y
  4612 Y(III)Cl3O2N2 (TIMNIM) (Geo)C4H10N2O2Cl3Y
  4613 Y(III)Cl3O2N2 (TIMNIM)C4H10N2O2Cl3Y
  4614 Y(III)O4Cl3 (FUXPET) (Geo)C6H14O4Cl3Y


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7
Y(Cp)2O2Cl (AGUVUT)
 <Y-Cl> <Y-O> <O-Y-Cl> <><><> <Y-C> GR=CCDC
  Y     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
 Cl     2.58781300 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.41664800 +1   79.8741720 +1    0.0000000 +0     1     2     0
  O     2.25420863 +1   94.8232102 +1 -173.2758710 +1     1     2     3
  C     2.65950400 +1  113.8587340 +1  109.4600704 +1     1     2     4
  C     1.45655795 +1  101.1144003 +1 -172.1535709 +1     5     1     2
  H     1.07535499 +1  123.3014560 +1  -86.0265256 +1     6     5     1
  C     1.37364160 +1  110.3350764 +1  179.8481591 +1     6     5     7
  H     1.06770389 +1  127.2912011 +1 -179.3753068 +1     8     6     5
  C     1.44378621 +1  108.4445168 +1 -177.9238714 +1     8     6     9
  C     1.39310894 +1  131.8419925 +1  179.8161508 +1    10     8     6
  H     1.08537440 +1  120.2766727 +1   -1.4408810 +1    11    10     8
  C     1.38885660 +1  118.8116535 +1 -179.0820648 +1    11    10    12
  H     1.08622112 +1  119.9131981 +1  179.2930812 +1    13    11    10
  C     1.40414506 +1  120.9068106 +1 -179.1740151 +1    13    11    14
  H     1.08778092 +1  119.0681360 +1  179.4737041 +1    15    13    11
  C     1.38809842 +1  121.1759727 +1 -179.4615817 +1    15    13    16
  H     1.08585056 +1  120.7120649 +1  179.4925045 +1    17    15    13
  C     1.43260336 +1  107.9029757 +1  179.9797976 +1    10     8    11
  C     1.49327623 +1  105.0819138 +1 -127.8614271 +1     5     1     6
  H     1.11222579 +1  109.4028812 +1  160.3277052 +1    20     5     1
  H     1.11049443 +1  110.1064412 +1  114.7680698 +1    20     5    21
  C     1.53183193 +1  113.0918659 +1  123.4410080 +1    20     5    22
  H     1.11464214 +1  112.7730863 +1   49.6760786 +1    23    20     5
  C     1.53318812 +1  113.3729714 +1  131.4980193 +1    23    20    24
  H     1.10307306 +1  111.2111438 +1 -135.2928343 +1    25    23    20
  H     1.10220049 +1  112.0278773 +1  118.2744748 +1    25    23    26
  C     1.54298449 +1  105.6597554 +1  121.3746741 +1    25    23    27
  H     1.10170827 +1  111.5738214 +1 -124.1733900 +1    28    25    23
  H     1.10290234 +1  110.8593923 +1 -117.9642811 +1    28    25    29
  C     1.43535033 +1  124.3813136 +1   -4.2084569 +1     3     1     2
  H     1.10343914 +1  103.3101660 +1   69.5281337 +1    31     3     1
  H     1.10409437 +1  108.2557179 +1 -118.1310265 +1    31     3    32
  C     3.12683108 +1  129.9152906 +1 -161.3440974 +1     1     2     5
  C     1.41153951 +1   70.3410146 +1  -45.3041184 +1    34     1     2
  H     1.07085777 +1  125.7296130 +1  108.3141764 +1    35    34     1
  C     1.42505677 +1  109.0386659 +1  179.2896943 +1    35    34    36
  H     1.06390910 +1  126.2342206 +1 -175.1022177 +1    37    35    34
  C     1.42941791 +1  107.3394662 +1  169.9123136 +1    37    35    38
  C     1.40490491 +1  132.1245677 +1 -179.3510222 +1    39    37    35
  H     1.08463580 +1  119.6415153 +1    3.3144633 +1    40    39    37
  C     1.37810525 +1  118.9041205 +1  178.5988475 +1    40    39    41
  H     1.08646221 +1  120.3107199 +1 -179.3590679 +1    42    40    39
  C     1.41549736 +1  121.1730952 +1  179.1684686 +1    42    40    43
  H     1.08625268 +1  118.6052377 +1 -179.1950103 +1    44    42    40
  C     1.37896533 +1  121.1351226 +1  179.5716668 +1    44    42    45
  H     1.08519428 +1  121.1751071 +1 -179.3068317 +1    46    44    42
  C     1.42987300 +1   85.3211318 +1 -111.0060701 +1    34     1    35
  C     1.47930165 +1  104.7602441 +1 -126.0376465 +1    34     1    48
  H     1.11026295 +1  111.1399104 +1  141.5100762 +1    49    34     1
  H     1.10895595 +1  111.0338005 +1  117.3785425 +1    49    34    50
  C     1.47160350 +1  121.2754170 +1  178.2780124 +1     4     1     2
  H     1.11893654 +1  102.8441696 +1  -36.8560833 +1    52     4     1
  C     1.52564088 +1  105.9398504 +1 -119.0774449 +1    52     4    53
  H     1.10711789 +1  110.7282568 +1  112.3594708 +1    54    52     4
  H     1.10276299 +1  112.2395570 +1  118.2681689 +1    54    52    55
  C     1.54021197 +1  106.1727748 +1  121.7294505 +1    54    52    56
  H     1.10446376 +1  110.9133345 +1 -100.5943403 +1    57    54    52
  H     1.10367925 +1  111.4589448 +1 -118.1707910 +1    57    54    58
  C     1.44418780 +1  118.9831442 +1 -144.8770310 +1     4     1    52
  H     1.11046368 +1  106.2497619 +1   48.7747599 +1    60     4     1
  H     1.10642917 +1  103.1095146 +1 -117.8537237 +1    60     4    61