Accuracy

Mn2(CO)10C2 (JIPVOT) r   3308 Mn2(CO)10C2 (JIPVOT) (Geo)

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    #  Species Formula
  3298 Mn(CO)3ClS2 (GEQLUJ)C7H10O3S2ClMn
  3299 Manganese(IV) oxide dichloride (Geo)OCl2Mn
  3300 Mn(II)Cl2N4 (MUPYUR) (Geo)C12H12N4O2Cl2Mn
  3301 Mn(II)(H2O)4Cl2(trans)H8O4Cl2Mn
  3302 Mn(II)(H2O)4Cl2(trans) (Geo)H8O4Cl2Mn
  3303 Mn2(Ac)4C8H12O8Mn2
  3304 Mn2(Ac)4 (Geo)C8H12O8Mn2
  3305 Mn2(CO)9C9O9Mn2
  3306 Mn2(CO)10C10O10Mn2
  3307 Mn2(CO)10 (Geo)C10O10Mn2
  3308 Mn2(CO)10C2 (JIPVOT) (Geo) C12O10Mn2
  3309 Mn2(CO)8(CF2)2 (DOFPET) (Geo)C10O8F4Mn2
  3310 Mn(II)2Cl6O4(=) (IPRAMN01) (Geo)H8O4Cl6Mn2
  3311 Iron(+) 6D(g) 4s(1)3d(6)Fe
  3312 Iron, cationFe
  3313 Iron, 3F(g) 3d(7)4s(1)Fe
  3314 Iron, atomFe
  3315 FeH(+) (Geo)HFe
  3316 FeH (Geo)HFe
  3317 Fe-CH3CH3Fe
  3318 Fe(III)Cp2(+) (FERRIC) (Geo)C10H10Fe


REF: The Cambridge Structural Database: a quarter of a million crystal structures and rising. F. H. Allen, Acta Cryst. B58, 380-388, (2002)
  
 PM7
Mn2(CO)10C2 (JIPVOT)
 <Mn-C(O)> <Mn-C'(O)><> <><><> <><><> <><><> <Mn-C(C)> GR=CCDC
 Mn     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.86352600 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.83425300 +1   94.9691762 +1    0.0000000 +0     1     2     0
  C     1.85844431 +1  170.4105832 +1  176.9959970 +0     1     2     3
  C     1.85823991 +1   89.8375868 +1   88.3320602 +1     1     2     4
  C     1.85911207 +1   89.3678074 +1 -170.6099700 +0     1     2     5
  C     1.97243941 +1   85.0326974 +1   85.8939470 +1     1     2     6
  O     1.14762556 +1  140.8859018 +1  179.7309435 +1     2     3     1
  O     1.15244430 +1  137.2794391 +1 -179.9885165 +1     3     2     1
  O     1.14764060 +1  172.4781821 +1  178.1132583 +1     4     2     1
  O     1.14773546 +1  134.6162990 +1  175.7946836 +1     5     2     1
  O     1.14772759 +1  134.3559793 +1 -175.9588098 +1     6     2     1
  C     1.21380983 +1  134.4100890 +1 -179.6230590 +0     7     2     1
 Mn     1.97190099 +1  179.9347108 +1  -29.4170911 +1    13     7     4
  C     1.85874895 +1   85.3356662 +1   -1.3941344 +1    14    13     4
  C     1.83220827 +1   94.6570815 +1  179.9991099 +1    14    15    13
  C     1.85865918 +1   85.3497893 +1  179.9959319 +1    14    13    15
  C     1.85873088 +1   85.3752610 +1  -89.9672807 +1    14    13    17
  C     1.85854058 +1   85.3694206 +1  179.9839140 +1    14    13    18
  O     1.14774994 +1  128.2916536 +1  179.9690061 +1    15    13    14
  O     1.15236439 +1  179.9288228 +1  112.9411905 +1    16    14    19
  O     1.14772360 +1  128.2136646 +1 -179.9804379 +1    17    13    14
  O     1.14776730 +1  128.2374427 +1 -179.9829430 +1    18    13    14
  O     1.14777989 +1  128.2070895 +1 -179.9652320 +1    19    13    14