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Experimental descriptions of available bonds, angles and dihedrals.

This tables lists the coordinate description and how many of that type are in the CCCBDB for experimental coordinates. Click on the description for a comparison of Theory with experiment.
descriptionCount descriptionCount descriptionCount descriptionCount
rAlAl 1 rAlCl 4 rAlF 2 rAlH 3
rAlO 1 rAlS 1 rArAr 1 rAsAs 2
rBB 4 rBBr 2 rBC 1 rBCl 4
rBeBe 1 rBeCl 2 rBeF 2 rBeH 1
rBeO 1 rBeS 1 rBF 4 rBH 10
rBN 3 rBO 3 rBrBr 1 rBrI 1
rBrO 1 rBS 2 rCAl 1 rCBr 10
rCC 410 rCCl 47 rCF 41 rCFe 1
rCGe 1 rCH 391 rCI 2 rClAs 1
rClBr 1 rClCa 1 rClCl 4 rClGa 2
rClGe 2 rClI 1 rClO 5 rClTi 1
rCN 81 rCO 123 rCP 4 rCS 26
rCSe 4 rCSi 1 rCuCl 1 rCuCu 1
rCuF 1 rCuO 1 rDCl 1 rDD 1
rDF 1 rDH 1 rDO 1 rDS 1
rFAs 1 rFBr 5 rFCa 1 rFCl 6
rFF 5 rFGa 2 rFGe 1 rFI 1
rFMg 1 rFO 5 rFP 7 rFS 3
rFSc 1 rFSi 2 rGaAs 1 rHAl 2
rHAr 1 rHAs 2 rHB 3 rHBe 1
rHBr 4 rHC 26 rHCa 1 rHCl 4
rHCu 1 rHeHe 1 rHF 4 rHGa 1
rHGe 2 rHH 1 rHI 1 rHK 1
rHMg 2 rHN 9 rHO 11 rHP 8
rHS 2 rHSc 1 rHSe 3 rHSi 4
rHZn 2 rII 1 rKBr 1 rKCl 1
rKF 1 rKK 1 rLiBr 1 rLiCl 4
rLiF 1 rLiH 1 rLiK 1 rLiLi 1
rLiNa 1 rLiO 3 rLiS 1 rMgCl 2
rMgF 1 rMgH 2 rMgMg 1 rMgO 2
rMgS 1 rNaBr 1 rNaCl 2 rNaF 1
rNaH 1 rNaK 1 rNAl 1 rNaNa 1
rNaO 1 rNAs 2 rNBr 1 rNCl 3
rNeNe 4 rNF 6 rNH 32 rNN 15
rNO 48 rN-O 1 rNS 4 rO=Ti 1
rOBr 1 rOCa 1 rOCl 5 rOF 1
rOGa 1 rOH 30 rON 1 rOO 17
rOP 2 rOS 8 rOSc 1 rPBr 1
rPCl 5 rPF 1 rPH 9 rPN 1
rPO 6 rPP 6 rPS 1 rSCl 7
rSD 1 rSeO 2 rSeSe 1 rSF 5
rSH 12 rSiC 3 rSiCl 7 rSiF 3
rSiH 12 rSiN 1 rSiO 1 rSiP 1
rSiS 1 rSiSi 2 rSO 12 rSS 10
rSSe 1 rSZn 1 rTiCl 1 rVO 1
rZnC 1

Angles

descriptionCount descriptionCount descriptionCount descriptionCount
aBBCl 1 aBBF 1 aBHB 1 aBNB 1
aBrCBr 3 aBrPBr 1 aCCBr 1 aCCC 217
aCCCl 37 aCCF 21 aCCH 8 aCCN 27
aCCO 66 aCCS 16 aClAlCl 2 aClAsCl 1
aClBCl 2 aClCBr 1 aClCCl 14 aClGeCl 1
aClNaCl 1 aClOCl 1 aClPCl 2 aClSCl 3
aClSiCl 5 aCNC 17 aCNN 6 aCNO 6
aCOC 20 aCOCl 1 aCOF 1 aCON 7
aCOO 1 aCSC 11 aCSiC 1 aCSiCl 1
aCSiH 1 aCSO 2 aCSS 1 aDSD 1
aFBF 3 aFBrF 3 aFCBr 1 aFCCl 5
aFCF 21 aFCI 1 aFClF 4 aFCO 2
aFNF 3 aFOF 1 aFPF 2 aFSCl 1
aFSF 9 aFSiF 3 aHAlH 1 aHAsH 1
aHBCl 1 aHBeH 1 aHBF 1 aHBH 4
aHBN 2 aHBS 1 aHCBr 4 aHCC 253
aHCCl 8 aHCF 12 aHCGe 1 aHCH 191
aHCI 1 aHCN 30 aHCO 33 aHCP 4
aHCS 21 aHCSi 4 aHCZn 1 aHFF 2
aHGeC 1 aHGeH 2 aHNB 2 aHNC 17
aHNH 11 aHNN 5 aHNO 2 aHOBr 1
aHOC 17 aHOCl 2 aHOF 1 aHOH 2
aHOLi 1 aHOMg 1 aHON 4 aHOO 3
aHOS 1 aHPC 2 aHPH 3 aHPO 1
aHPP 2 aHSC 8 aHSeC 1 aHSeH 1
aHSH 1 aHSiC 1 aHSiCl 3 aHSiF 1
aHSiH 9 aHSiSi 1 aHSS 1 aNBN 1
aNCN 6 aNCO 6 aNNF 1 aNNO 7
aNOF 1 aOBO 1 aOCCl 2 aOCF 1
aOClF 1 aOClO 6 aOCO 12 aOCS 1
aOCSe 1 aOLiO 1 aONBr 1 aONCl 2
aONF 2 aONO 22 aOOCl 1 aOOF 1
aOOO 2 aOOX 2 aOPCl 1 aOPF 1
aOPO 1 aOSCl 2 aOSeO 1 aOSF 1
aOSO 7 aOSS 1 aPPP 1 aSCS 1
aSSCl 2 aSSS 1 aXCF 1 aXNF 1
aXNH 1 aXPCl 1 aXPF 1 aXPH 1
aXSiH 1