Accuracy

mg(ii)(cp)co2 (huxsau) r   1758 Mg(II)(Cp)CO2 (HUXSAU) (Geo)

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    #  Species Formula
  1748 Magnesium oxide (Geo)OMg
  1749 Magnesium hydroxideHOMg
  1750 Magnesium hydride hydroxideH2OMg
  1751 Magnesium hydride hydroxide (Geo)H2OMg
  1752 Magnesium cyanide hydroxideHCNOMg
  1753 Magnesium cyanide hydroxide (Geo)HCNOMg
  1754 Magnesium di-hydroxideH2O2Mg
  1755 Magnesium di-hydroxide (Geo)H2O2Mg
  1756 Mg(II)C2O2 (DOBXIB) (Geo)C10H22O2Mg
  1757 Mg(II)C2O2 (DOBXIB)C10H22O2Mg
  1758 Mg(II)(Cp)CO2 (HUXSAU) (Geo) C18H26O2Mg
  1759 Mg(II)(Cp)CO2 (HUXSAU)C18H26O2Mg
  1760 MgHNO2 (Geo)HNO2Mg
  1761 MgH(ONO) (Geo)HNO2Mg
  1762 Mg(II)O4(2+) (INSMGC) (Geo)H8O4Mg
  1763 Mg(II)O4(2+) (INSMGC)H8O4Mg
  1764 Magnesium di-acetylacetonateC10H14O4Mg
  1765 Magnesium di-acetylacetonate (Geo)C10H14O4Mg
  1766 MgN3O2C16H11N5O4Mg
  1767 MgN3O2 (Geo)C16H11N5O4Mg
  1768 Mg(OH)2.4(H2O)H10O6Mg


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7
Mg(II)(Cp)CO2 (HUXSAU)
 <Mg-O> <><O-Mg-O> <Mg-C(Cp)><><> <Mg-C> GR=CCDC
 Mg     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  O     2.08839000 +1    0.0000000 +0    0.0000000 +0     1     0     0
  O     2.08832738 +1   90.1426070 +1    0.0000000 +0     1     2     0
  C     2.42137900 +1  126.4029727 +1 -110.5596655 +1     1     2     3
  C     2.28195700 +1  105.0770759 +1 -156.3712216 +1     1     2     4
  C     1.40568101 +1  105.9910904 +1   76.9494436 +1     4     1     2
  H     1.06582011 +1  125.9053695 +1  110.4805636 +1     6     4     1
  C     1.41582194 +1  108.4618946 +1  177.8475687 +1     6     4     7
  H     1.06555689 +1  125.5486831 +1 -178.1528858 +1     8     6     4
  C     1.40190756 +1  108.4634590 +1  178.1588042 +1     8     6     9
  H     1.06651799 +1  125.9867434 +1 -177.8531916 +1    10     8     6
  C     2.30113415 +1   88.9573332 +1  121.0449076 +1     5     1     2
  H     1.06700944 +1  163.0204596 +1   84.7729072 +1    12     5     1
  C     1.39530066 +1   36.6147648 +1    0.8826885 +1    12     5    13
  H     1.06777942 +1  126.5230345 +1  175.7475171 +1    14    12     5
  H     1.07063644 +1  105.2988678 +1  160.5943968 +1     5     1    12
  C     1.43814506 +1   95.6278845 +1  128.4752685 +1     5     1    16
  H     1.06627133 +1  124.9964726 +1  -97.3263900 +1    17     5     1
  C     1.39432942 +1  108.5300593 +1 -176.5439271 +1    17     5    18
  H     1.06604320 +1  126.5574615 +1 -179.6455706 +1    19    17     5
  C     1.43684104 +1  114.2363026 +1  -54.4156392 +1     2     1     3
  H     1.10239607 +1  103.3027518 +1   85.3688020 +1    21     2     1
  H     1.10722146 +1  108.4417098 +1 -117.4307084 +1    21     2    22
  C     1.52883971 +1  106.3204985 +1 -121.6541478 +1    21     2    23
  H     1.10281517 +1  111.5815038 +1 -101.6090727 +1    24    21     2
  H     1.10262043 +1  111.6977459 +1 -118.7180911 +1    24    21    25
  C     1.54228831 +1  105.1018629 +1 -121.0498911 +1    24    21    26
  H     1.10365887 +1  111.3322980 +1  117.5613919 +1    27    24    21
  H     1.10290436 +1  110.9928022 +1  117.9794055 +1    27    24    28
  C     1.44086426 +1  111.5129302 +1 -124.4576589 +1     2     1    21
  H     1.10970456 +1  108.0835996 +1   31.6285686 +1    30     2     1
  H     1.10554874 +1  102.8559622 +1 -117.6173442 +1    30     2    31
  C     1.44312236 +1  110.8695558 +1  177.7021032 +1     3     1     2
  H     1.10946962 +1  107.5911234 +1   20.2602473 +1    33     3     1
  H     1.10316445 +1  103.4143830 +1 -117.7365467 +1    33     3    34
  C     1.52638578 +1  106.8339357 +1 -121.4882060 +1    33     3    35
  H     1.10263146 +1  112.2820451 +1 -146.5452947 +1    36    33     3
  H     1.10315174 +1  111.6922844 +1 -119.3877349 +1    36    33    37
  C     1.53802499 +1  103.6294586 +1 -119.8192685 +1    36    33    38
  H     1.10994298 +1  110.8198354 +1  -92.7862852 +1    39    36    33
  H     1.10000091 +1  112.2219440 +1 -118.8772962 +1    39    36    40
  C     1.44386809 +1  112.9568349 +1  124.4354157 +1     3     1    33
  H     1.10223526 +1  103.9861060 +1  116.8744985 +1    42     3     1
  H     1.11167204 +1  106.7208190 +1 -117.4378565 +1    42     3    43
  C     1.44696227 +1   68.0445845 +1 -102.9854675 +1     4     1     6
  H     1.07318948 +1  125.0072223 +1  -96.4153010 +1    45     4     1
  H     1.07305618 +1  102.1844363 +1 -123.2777694 +1     4     1    45