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["file","supp-1%.xls"]
["unit","cm-1","cm-1","cm-1"]
["molecule","we_obs","We_cal","cal-obs","(cal-obs)%","{A2+B2}"]
["(As P)",604.04,603.4811124,-0.5588876,-0.09252493212370043,"{AsAs+ P P}"]
["( KRb)",75.8418,75.7074386,-0.1343614,-0.1771600885000092,"{ K K+RbRb}"]
["(SbAs)",343,341.9448475,-1.0551525,-0.3076246355685131,"{SbSb+AsAs}"]
["(AuCl)",383.6,382.1479877,-1.4520123,-0.37852249739311783,"{AuAu+ClCl}"]
["(BrCl)",444,442.2499885,-1.7500115,-0.39414673423423424,"{BrBr+ClCl}"]
["(RbCs)",50.0137382,49.7845836,-0.2291545,-0.45818310777657495,"{RbRb+CsCs}"]
["( H O)",3737.761,3718.948694,-18.812306,-0.5033041438444031,"{ H H+ O O}"]
["(BiSb)",220,218.7004729,-1.2995271,-0.5906941363636363,"{BiBi+SbSb}"]
["(Se S)",555.56,552.0753523,-3.4846477,-0.627231568147455,"{SeSe+ S S}"]
["(Lu H)",1520,1509.8805786,-10.1194214,-0.6657514078947369,"{LuLu+ H H}"]
["(Bi F)",511,507.4093261,-3.5906739,-0.7026759099804305,"{BiBi+ F F}"]
["(Au H)",2305.50082,2287.8362598,-17.6645602,-0.7661918853709191,"{AuAu+ H H}"]
["(AgCu)",231.8,229.9499791,-1.8500209,-0.7981108283002589,"{AgAg+CuCu}"]
["(SiCl)",535.59,531.026937,-4.563063,-0.8519694169047218,"{SiSi+ClCl}"]
["(Bi S)",408.71,405.0464982,-3.6635018,-0.8963572704362507,"{BiBi+ S S}"]
["(NaLi)",256.99,254.4642907,-2.5257093,-0.982804506011907,"{NaNa+LiLi}"]
["( S F)",837.6418,829.3661823,-8.2756177,-0.987966180770826,"{ S S+ F F}"]
[]
["molecule","we_obs","We_cal","we_cal-we_obs","(cal-obs)%","A2{AB-B2}/B2{AB-A2}"]
["(AsAs)",429.55,430.2397756,0.6897756,0.16058098009544874,"{As P- P P}"]
["( P P)",780.77,782.4839569,1.7139569,0.2195213571218156,"{ PAs-AsAs}"]
["(RbRb)",57.7891594,57.979581,0.1904216,0.329510935921314,"{Rb K- K K}"]
["( K K)",92.4,92.7574839,0.3574839,0.3868873376623377,"{ KRb-RbRb}"]
["(SeSe)",385.303,387.0437935,1.7407935,0.4517985844906477,"{Se S- S S}"]
["(AuAu)",190.9,192.1050597,1.2050597,0.6312518072289157,"{AuCl-ClCl}"]
["( S S)",725.7102,730.3768051,4.6666051,0.6430397560899654,"{ SSe-SeSe}"]
["( H H)",4401.21,4434.4799286,33.2699286,0.7559268610223098,"{ H O- O O}"]
["(LuLu)",121.6,122.524156,0.924156,0.7599967105263159,"{Lu H- H H}"]
["(AsAs)",429.55,432.962443,3.412443,0.7944227680130369,"{AsSb-SbSb}"]
["(CsCs)",42.022,42.3775436,0.3555436,0.8460891913759461,"{CsRb-RbRb}"]
["(SbSb)",269.98,272.4635464,2.4835464,0.9199001407511667,"{SbAs-AsAs}"]
["(ClCl)",559.751,565.171518,5.420518,0.9683802262077246,"{ClAu-AuAu}"]
["(BiBi)",172.71,174.4162349,1.7062349,0.9879189971628742,"{Bi F- F F}"]
[]
["Molecule","    We_obs","We_cal","Calc.-obs.","(cal-obs)%","AB{AX+BY-XY}"]
["(BrCs)",149.66,149.6698624,0.0098624,0.006589870372845116,"{Br K+Cs F- K F}"]
["( HSi)",2042.5229,2042.381289,-0.141611,-0.006933141361597463,"{ H B+Si F- B F}"]
["( KBr)",213,212.9850273,-0.0149727,-0.0070294366197183105,"{ K F+BrCs- FCs}"]
["( H B)",2366.7296,2366.9386733,0.2090733,0.008833848192881855,"{ HSi+ B F-Si F}"]
["(BrSr)",216.5,216.5248992,0.0248992,0.011500785219399538,"{BrLi+SrCl-LiCl}"]
["(LiBr)",563.1,563.0321358,-0.0678642,-0.012051891315929673,"{LiCl+BrSr-ClSr}"]
["( FCs)",352.56,352.5167412,-0.0432588,-0.01226991150442478,"{ F K+CsBr- KBr}"]
["(ClSr)",302.3,302.2592363,-0.0407637,-0.013484518690043003,"{ClLi+SrBr-LiBr}"]
["( FSi)",837.32507,837.4385622,0.1134922,0.01355413853785603,"{ F B+Si H- B H}"]
["( F K)",428,428.0594888,0.0594888,0.013899252336448597,"{ FCs+ KBr-CsBr}"]
["(LiCl)",642.95453,643.0461899,0.0916599,0.01425604700226624,"{LiBr+ClSr-BrSr}"]
["( HAl)",1682.37474,1682.0967099,-0.2780301,-0.016526050551614914,"{ HGa+Al O-Ga O}"]
["( OCu)",640.17,640.3173817,0.1473817,0.023022275333114645,"{ O H+Cu F- H F}"]
["( B F)",1402.15865,1401.8305525,-0.3280975,-0.02339945625981767,"{ B H+ FSi- HSi}"]
["( HGa)",1605,1605.37931,0.37931,0.02363302180685358,"{ HAl+Ga O-Al O}"]
["( FCu)",622.65,622.4949327,-0.1550673,-0.024904408576246685,"{ F H+Cu O- H O}"]
["( IBa)",152.3,152.2600151,-0.0399849,-0.026254038082731447,"{ ISr+BaBr-SrBr}"]
["(Br I)",269,269.0711897,0.0711897,0.026464572490706318,"{BrBr+ I H-Br H}"]
["(Sr I)",174.1,174.1469754,0.0469754,0.02698184951177484,"{SrBr+ IBa-BrBa}"]
["(BrAg)",247.7,247.7692533,0.0692533,0.02795853855470327,"{Br I+AgCl- ICl}"]
["(NaCl)",364.6842,364.5714033,-0.1127967,-0.030929966255735786,"{Na O+ClLi- OLi}"]
["(BrBa)",193.8,193.8626242,0.0626242,0.03231382868937049,"{BrSr+Ba I-Sr I}"]
["(BrSr)",216.5,216.4277327,-0.0722673,-0.03337981524249423,"{BrBa+Sr I-Ba I}"]
["( SBi)",408.71,408.5648109,-0.1451891,-0.03552374544297913,"{ SAl+Bi O-Al O}"]
["(CuBr)",314.8,314.915659,0.115659,0.03674047013977128,"{CuCl+BrBr-ClBr}"]
["( ONa)",492.3,492.4888995,0.1888995,0.03837081048141377,"{ OLi+NaCl-LiCl}"]
["(LiCl)",642.95453,643.2152259,0.2606959,0.04054655311317271,"{Li O+ClNa- ONa}"]
["(Al S)",617.1169,617.3809683,0.2640683,0.04279064468984725,"{Al O+ SBi- OBi}"]
["(BrBr)",325.321,325.1773174,-0.1436826,-0.04416640794784228,"{BrCu+BrCl-CuCl}"]
["( OGa)",767.5,767.147414,-0.352586,-0.04593954397394137,"{ OAl+Ga H-Al H}"]
["(BrRb)",169.46,169.3796853,-0.0803147,-0.047394488374837715,"{BrLi+RbCl-LiCl}"]
["(ClAg)",343.49,343.3224381,-0.1675619,-0.048782177064834495,"{Cl H+AgBr- HBr}"]
["( IAu)",215.77,215.6610205,-0.1089795,-0.05050725309357186,"{ I H+AuAu- HAu}"]
["(AuAu)",190.9,190.9964498,0.0964498,0.05052372970141435,"{Au I+Au H- I H}"]
["(ClRb)",228,228.1186341,0.1186341,0.052032499999999995,"{ClLi+RbBr-LiBr}"]
["(Li O)",814.64,814.1980846,-0.4419154,-0.05424671020327998,"{LiCl+ ONa-ClNa}"]
["(BrRb)",169.46,169.3679594,-0.0920406,-0.0543140564144931,"{BrSr+RbCl-SrCl}"]
["( OBi)",692.4,692.7787714,0.3787714,0.054704130560369726,"{ OAl+Bi S-Al S}"]
["( OAl)",979.4852,980.05294,0.56774,0.05796310143328353,"{ OGa+Al H-Ga H}"]
["( H O)",3737.761,3735.5827928,-2.1782072,-0.05827572174892938,"{ H F+ OCu- FCu}"]
["(ClRb)",228,228.1359837,0.1359837,0.05964197368421053,"{ClSr+RbBr-SrBr}"]
["(CuAu)",250,249.8426414,-0.1573586,-0.06294343999999999,"{Cu S+Au F- S F}"]
["(Li I)",498.16,497.8301243,-0.3298757,-0.06621882527701943,"{Li H+ IMg- HMg}"]
["(SeTe)",316,315.790342,-0.209658,-0.06634746835443038,"{SeSe+TeBr-SeBr}"]
["( HLi)",1405.49805,1406.4820834,0.9840334,0.07001314587380608,"{ HMg+Li I-Mg I}"]
["( STe)",471.18,470.8440198,-0.3359802,-0.07130612504775245,"{ S H+Te O- H O}"]
["( H F)",4138.4,4141.3901487,2.9901487,0.07225373815967524,"{ H O+ FCu- OCu}"]
["( OAl)",979.4852,978.7618573,-0.7233427,-0.07384927306711729,"{ OBi+Al S-Bi S}"]
["( HAu)",2305.50082,2303.7743044,-1.7265156,-0.07488679184247699,"{ H I+AuAu- IAu}"]
["( H I)",2309,2310.7334948,1.7334948,0.07507556517973148,"{ HAu+ IAu-AuAu}"]
["( SCu)",415,415.3206642,0.3206642,0.07726848192771084,"{ S F+CuAu- FAu}"]
["( HBi)",1636,1634.7242252,-1.2757748,-0.07798134474327628,"{ HSi+BiCl-SiCl}"]
["(AsSb)",343,342.7320193,-0.2679807,-0.07812848396501458,"{As F+Sb P- F P}"]
["(BrRb)",169.46,169.5930454,0.1330454,0.07851138911837602,"{BrNa+RbCl-NaCl}"]
["(Mg I)",316,316.2560425,0.2560425,0.08102610759493671,"{Mg H+ ILi- HLi}"]
["(LiBr)",563.1,563.5651202,0.4651202,0.08259992896465991,"{LiCl+BrRb-ClRb}"]
["(ClBi)",308.4,308.655866,0.255866,0.0829656290531777,"{ClSi+Bi H-Si H}"]
["(ClRb)",228,227.8042641,-0.1957359,-0.08584907894736842,"{ClNa+RbBr-NaBr}"]
["( HMg)",1492.7763,1491.4853952,-1.2909048,-0.08647677485233388,"{ HLi+Mg I-Li I}"]
["( PSb)",500.07,500.5137862,0.4437862,0.0887448157257984,"{ P F+SbAs- FAs}"]
["( H S)",2696.2475,2698.650574,2.403074,0.08912661022402432,"{ H O+ STe- OTe}"]
["(BrSr)",216.5,216.6955638,0.1955638,0.09032969976905313,"{BrRb+SrCl-RbCl}"]
["(AuAu)",190.9,191.0725648,0.1725648,0.09039539025667889,"{Au F+AuCl- FCl}"]
["(AgAu)",198.22,198.0383626,-0.1816374,-0.09163424477852891,"{AgCl+AuCl-ClCl}"]
["( HRb)",936.94,937.8098915,0.8698915,0.09284388541422076,"{ H K+RbCl- KCl}"]
["(CuAg)",231.8,232.0206678,0.2206678,0.09519749784296806,"{CuAu+AgAg-AuAg}"]
["(BrAg)",247.7,247.4618558,-0.2381442,-0.0961421881308034,"{Br H+Ag I- H I}"]
["(LiCl)",642.95453,642.3282719,-0.6262581,-0.0974031709520734,"{LiBr+ClRb-BrRb}"]
["( H K)",983.6,982.6101722,-0.9898278,-0.10063316388775927,"{ HRb+ KCl-RbCl}"]
["( HBr)",2649,2646.305521,-2.694479,-0.10171683654209135,"{ HCl+BrAg-ClAg}"]
["( FAs)",685.78,686.4836426,0.7036426,0.10260471288168217,"{ F P+AsSb- PSb}"]
["(ClAg)",343.49,343.850467,0.360467,0.1049425019651227,"{ClCl+AgAu-ClAu}"]
["(ClSr)",302.3,301.9806595,-0.3193405,-0.10563695004961958,"{ClRb+SrBr-RbBr}"]
["(NaBr)",302.1,301.7728304,-0.3271696,-0.10829844422376696,"{NaCl+BrRb-ClRb}"]
["(ClAu)",383.6,383.1790723,-0.4209277,-0.10973089155370178,"{Cl F+AuAu- FAu}"]
["( F S)",837.6418,838.5784115,0.9366115,0.11181527712681007,"{ F C+ S O- C O}"]
["( OTe)",797.11,798.015445,0.905445,0.11359097238775075,"{ O H+Te S- H S}"]
["( HNa)",1171.968,1170.6176501,-1.3503499,-0.11522071421745303,"{ HCa+NaBr-CaBr}"]
["(ClCu)",415.29,415.7685119,0.4785119,0.11522355462447928,"{ClAg+Cu I-Ag I}"]
["( PAs)",604.04,603.3399548,-0.7000452,-0.11589384808953052,"{ P C+As O- C O}"]
["( FAu)",563.697,564.3541497,0.6571497,0.11657853421252906,"{ F S+AuCu- SCu}"]
["( HSi)",2042.5229,2044.9379165,2.4150165,0.1182369362908979,"{ HBi+SiCl-BiCl}"]
["(BrAg)",247.7,247.9935441,0.2935441,0.1185079127977392,"{BrTe+Ag I-Te I}"]
["( F P)",846.75,845.7242878,-1.0257122,-0.1211351874815471,"{ FAs+ PSb-AsSb}"]
["(AgAu)",198.22,198.4614884,0.2414884,0.12182847341337907,"{AgAg+AuCu-AgCu}"]
["(NaCl)",364.6842,365.1341599,0.4499599,0.12338343695723589,"{NaBr+ClRb-BrRb}"]
["(BrPb)",207.5,207.7630522,0.2630522,0.12677214457831326,"{BrBi+Pb F-Bi F}"]
["(BrBi)",209.5,209.2299521,-0.2700479,-0.12890114558472554,"{BrPb+Bi F-Pb F}"]
["(ClCl)",559.751,559.0292245,-0.7217755,-0.12894581697933546,"{Cl F+Cl N- F N}"]
["(SiCl)",535.59,534.8968945,-0.6931055,-0.12940971638753523,"{Si H+ClBi- HBi}"]
["( K I)",186.53,186.7724457,0.2424457,0.1299767865758859,"{ KBr+ ILi-BrLi}"]
["(CuAu)",250,249.6678374,-0.3321626,-0.13286504,"{CuAg+AuAg-AgAg}"]
["(SbSb)",269.98,269.6145248,-0.3654752,-0.13537121268242092,"{SbBr+SbBi-BrBi}"]
["(ClRb)",228,227.6893448,-0.3106552,-0.13625228070175438,"{Cl K+Rb H- K H}"]
["( FAu)",563.697,562.9179703,-0.7790297,-0.13820007912052043,"{ FCl+AuAu-ClAu}"]
["( PAs)",604.04,604.8871781,0.8471781,0.14025198662340244,"{ P P+As O- P O}"]
["( SAs)",567.94,568.7387256,0.7987256,0.14063556009437617,"{ SGe+As O-Ge O}"]
["(NaBr)",302.1,302.5281339,0.4281339,0.14171926514399205,"{Na H+BrCa- HCa}"]
["( SGe)",575.8,574.9745365,-0.8254635,-0.14335941299062177,"{ SAs+Ge O-As O}"]
["( K I)",186.53,186.2624303,-0.2675697,-0.14344593362997912,"{ KBr+ IBa-BrBa}"]
["( HCa)",1298.34,1300.216615,1.876615,0.14453956590723538,"{ HNa+CaBr-NaBr}"]
["(CuAg)",231.8,232.1377775,0.3377775,0.14571937014667816,"{CuBr+Ag H-Br H}"]
["(ClAu)",383.6,384.166213,0.566213,0.1476050573514077,"{ClCl+AuAg-ClAg}"]
["( KBr)",213,212.6854258,-0.3145742,-0.1476874178403756,"{ K I+BrLi- ILi}"]
["( SSe)",555.56,556.3827836,0.8227836,0.1480998632010944,"{ STe+SeBr-TeBr}"]
["( IBi)",163.8,163.5474109,-0.2525891,-0.15420579975579973,"{ IBe+BiBr-BeBr}"]
["(CuAg)",231.8,231.4418999,-0.3581001,-0.15448666954270923,"{CuAu+Ag H-Au H}"]
["(Cl K)",281,281.4346012,0.4346012,0.1546623487544484,"{ClRb+ K H-Rb H}"]
["( HCl)",2990.9,2995.5982458,4.6982458,0.15708468354007152,"{ HBr+ClAg-BrAg}"]
["(AsAs)",429.55,430.2397756,0.6897756,0.16058098009544874,"{As P+As P- P P}"]
["(ClAs)",443,442.2886166,-0.7113834,-0.16058316027088038,"{Cl C+As S- C S}"]
["( K I)",186.53,186.229434,-0.300566,-0.16113547418645796,"{ KBr+ ISr-BrSr}"]
["( NCl)",827.95767,829.2993245,1.3416545,0.16204385183121742,"{ N F+ClCl- FCl}"]
["(ClCu)",415.29,414.6133999,-0.6766001,-0.16292231934310963,"{ClAg+CuBr-AgBr}"]
["( KBr)",213,213.3502223,0.3502223,0.16442361502347416,"{ K I+BrBa- IBa}"]
["( P P)",780.77,779.4829366,-1.2870634,-0.16484539621143232,"{ P O+ PAs- OAs}"]
["(ClBr)",444,443.265982,-0.734018,-0.16531936936936936,"{ClAg+BrBr-AgBr}"]
["( H O)",3737.761,3731.5721383,-6.1888617,-0.1655767102283961,"{ H S+ OTe- STe}"]
["( C F)",1307.93,1305.7386988,-2.1913012,-0.16753963897150456,"{ C O+ F S- O S}"]
["( HAg)",1759.7496,1756.7943291,-2.9552709,-0.16793701217491394,"{ H O+Ag O- O O}"]
["(NaBr)",302.1,301.575457,-0.524543,-0.173632240979808,"{NaCl+BrLi-ClLi}"]
["(ClCu)",415.29,414.5685176,-0.7214824,-0.17372977919044522,"{Cl I+Cu F- I F}"]
["( F S)",837.6418,836.1652924,-1.4765076,-0.1762695701193517,"{ FAu+ SCu-AuCu}"]
["(Ag I)",206.52,206.8879449,0.3679449,0.1781642940151075,"{AgBr+ ICu-BrCu}"]
["( FCl)",783.4534,784.8532147,1.3998147,0.1786723626446704,"{ F N+ClCl- NCl}"]
["(Na I)",258,258.4625627,0.4625627,0.17928786821705425,"{Na O+ IBi- OBi}"]
["( OAs)",967.08,968.815669,1.735669,0.1794752243868139,"{ O C+As P- C P}"]
["( OAg)",490.2,491.094879,0.894879,0.18255385556915543,"{ O O+Ag H- O H}"]
["( STe)",471.18,472.0411903,0.8611903,0.18277310157476973,"{ SBe+Te O-Be O}"]
["(NaBr)",302.1,301.5466509,-0.5533491,-0.18316752730883815,"{NaCl+BrSr-ClSr}"]
["(BrBi)",209.5,209.8853799,0.3853799,0.18395221957040572,"{BrBe+Bi I-Be I}"]
["(ClCl)",559.751,558.7203622,-1.0306378,-0.18412433385558938,"{ClAg+ClAu-AgAu}"]
["(ClAs)",443,443.8177504,0.8177504,0.184593769751693,"{Cl N+As P- N P}"]
["( KBr)",213,213.3936366,0.3936366,0.18480591549295775,"{ K I+BrSr- ISr}"]
["(Li I)",498.16,499.0873057,0.9273057,0.1861461578609282,"{LiBr+ ICa-BrCa}"]
["(CaBr)",285.3,284.7653143,-0.5346857,-0.1874117420259376,"{Ca H+BrNa- HNa}"]
["( O S)",1150.7913,1148.628294,-2.163006,-0.1879581467117452,"{ O C+ S F- C F}"]
["( FCl)",783.4534,784.9466649,1.4932649,0.19060034712977186,"{ FAu+ClAu-AuAu}"]
["(ClCa)",367.53,368.2323359,0.7023359,0.1910962098332109,"{ClPb+Ca O-Pb O}"]
["( C P)",1239.79924,1242.199452,2.400212,0.19359682782189797,"{ C O+ PAs- OAs}"]
["(Ca I)",238.7,238.2363081,-0.4636919,-0.19425718475073314,"{CaBr+ ILi-BrLi}"]
["(NaCl)",364.6842,365.4071285,0.7229285,0.19823411598308893,"{NaBr+ClLi-BrLi}"]
["(BrAu)",264.4,264.930479,0.530479,0.20063502269288958,"{BrCl+AuCl-ClCl}"]
["(NaBr)",302.1,301.4935801,-0.6064199,-0.2007348229063224,"{Na O+BrLi- OLi}"]
["(Li I)",498.16,497.135212,-1.024788,-0.20571462983780311,"{LiBr+ I K-Br K}"]
["(ClCa)",367.53,366.7692696,-0.7607304,-0.20698457268794385,"{ClBi+Ca S-Bi S}"]
["( FSr)",502.4,503.4488522,1.0488522,0.20876835191082804,"{ FBi+Sr O-Bi O}"]
["(NaCl)",364.6842,365.4470637,0.7628637,0.2091847412089693,"{NaBr+ClSr-BrSr}"]
["( HAg)",1759.7496,1756.0444487,-3.7051513,-0.2105499157380118,"{ HBr+AgCu-BrCu}"]
["(Cu I)",264.5,263.9428369,-0.5571631,-0.21064767485822308,"{CuBr+ IAg-BrAg}"]
["( IBa)",152.3,152.6246057,0.3246057,0.21313571897570582,"{ I K+BaBr- KBr}"]
["( OAs)",967.08,964.9999831,-2.0800169,-0.21508219588865451,"{ O P+As P- P P}"]
["(CuAu)",250,250.5439127,0.5439127,0.21756508000000002,"{CuAg+Au H-Ag H}"]
["( P P)",780.77,782.4839569,1.7139569,0.2195213571218156,"{ PAs+ PAs-AsAs}"]
["(LiBr)",563.1,564.3366396,1.2366396,0.2196127863612147,"{LiCl+BrNa-ClNa}"]
["( IBi)",163.8,163.4381946,-0.3618054,-0.22088241758241758,"{ I F+Bi H- F H}"]
["(BrSr)",216.5,216.978611,0.478611,0.2210674364896074,"{BrNa+SrCl-NaCl}"]
["(ClAu)",383.6,382.7515479,-0.8484521,-0.22118146506777894,"{ClCl+AuBr-ClBr}"]
["(Be S)",997.94,995.7116949,-2.2283051,-0.2232904884061166,"{Be O+ STe- OTe}"]
["(ClCu)",415.29,414.362062,-0.927938,-0.22344337691733487,"{Cl H+CuBr- HBr}"]
["( HAg)",1759.7496,1763.7212791,3.9716791,0.22569569556941507,"{ HAu+AgCu-AuCu}"]
["(AgAg)",192.4,192.8376785,0.4376785,0.22748362785862788,"{AgAu+Ag H-Au H}"]
["(LiBr)",563.1,561.8101337,-1.2898663,-0.22906522820102998,"{Li I+BrCa- ICa}"]
["(AgAu)",198.22,197.7656006,-0.4543994,-0.22923993542528504,"{AgCl+AuBr-ClBr}"]
["(Be I)",611.7,613.1100821,1.4100821,0.23051857119503022,"{BeBr+ IBi-BrBi}"]
["(Te I)",217,217.5070532,0.5070532,0.23366506912442395,"{TeBr+ I H-Br H}"]
["( FBi)",511,512.1978542,1.1978542,0.23441373776908028,"{ FPb+BiBr-PbBr}"]
["(ClPb)",304,303.284379,-0.715621,-0.2354016447368421,"{ClCa+Pb O-Ca O}"]
["(ClBi)",308.4,309.1267754,0.7267754,0.2356599870298314,"{ClCa+Bi S-Ca S}"]
["(CuBr)",314.8,314.0564872,-0.7435128,-0.23618576874205843,"{CuAg+Br H-Ag H}"]
["( OAs)",967.08,964.7736527,-2.3063473,-0.23848567853745295,"{ OGe+As S-Ge S}"]
["( FBi)",511,509.7779238,-1.2220762,-0.23915385518591,"{ FSr+Bi O-Sr O}"]
["(ClBr)",444,442.9349626,-1.0650374,-0.2398732882882883,"{Cl H+BrBr- HBr}"]
["(ClBr)",444,445.0663613,1.0663613,0.240171463963964,"{Cl H+Br I- H I}"]
["( FPb)",503,501.7874733,-1.2125267,-0.241058986083499,"{ FBi+PbBr-BiBr}"]
["(AgAu)",198.22,198.701203,0.481203,0.24276208253455756,"{AgBr+AuBr-BrBr}"]
["(CaBr)",285.3,285.9956585,0.6956585,0.2438340343498072,"{Ca I+BrLi- ILi}"]
["(Br I)",269,268.3439826,-0.6560174,-0.24387263940520446,"{BrBr+ ITe-BrTe}"]
["(Sr I)",174.1,174.5283563,0.4283563,0.24604037909247561,"{SrBr+ I K-Br K}"]
["( N F)",1141.37,1138.5537092,-2.8162908,-0.24674652391424345,"{ NCl+ FCl-ClCl}"]
["( K I)",186.53,186.9913511,0.4613511,0.24733345842491827,"{ KBr+ ICa-BrCa}"]
["( OGe)",985.5,987.952735,2.452735,0.2488822932521563,"{ OAs+Ge S-As S}"]
["( SAs)",567.94,569.3576587,1.4176587,0.2496141669894707,"{ S C+AsCl- CCl}"]
["(CuBr)",314.8,315.5871603,0.7871603,0.2500509212198221,"{Cu I+BrAg- IAg}"]
["(LiBr)",563.1,564.5309906,1.4309906,0.2541272598117563,"{Li O+BrNa- ONa}"]
["( HBi)",1636,1631.8377393,-4.1622607,-0.25441691320293397,"{ HBe+Bi F-Be F}"]
["(LiBr)",563.1,564.5443718,1.4443718,0.25650360504350916,"{Li I+Br K- I K}"]
["(BrTe)",267.4,268.0876506,0.6876506,0.2571617801047121,"{BrSe+Te S-Se S}"]
["(ClSr)",302.3,301.5217729,-0.7782271,-0.2574353622229573,"{ClNa+SrBr-NaBr}"]
["(LiCl)",642.95453,641.2968767,-1.6576533,-0.2578181228461055,"{LiBr+ClNa-BrNa}"]
["(ClBr)",444,445.1528719,1.1528719,0.2596558333333333,"{ClAg+BrAu-AgAu}"]
["(BrBa)",193.8,193.2956123,-0.5043877,-0.26026197110423116,"{Br K+Ba I- K I}"]
["(ClAg)",343.49,344.3957867,0.9057867,0.26370103933156713,"{ClBr+AgAu-BrAu}"]
["( NCl)",827.95767,825.7338172,-2.2238528,-0.2685949874707967,"{ N P+ClAs- PAs}"]
["(BrTe)",267.4,266.6798705,-0.7201295,-0.26930796559461484,"{Br H+Te I- H I}"]
["( CCl)",876.89749,879.2786926,2.3812026,0.27154857063167104,"{ C S+ClAs- SAs}"]
["( HBe)",2061.235,2055.6044215,-5.6305785,-0.27316528683046815,"{ HSi+Be O-Si O}"]
["(Ag I)",206.52,205.9493888,-0.5706112,-0.27629827619601005,"{AgCl+ ICu-ClCu}"]
["(Cl I)",384,382.9386356,-1.0613644,-0.27639697916666667,"{ClCu+ IBr-CuBr}"]
["(ClCl)",559.751,561.3148109,1.5638109,0.2793761690465939,"{ClBr+ClAu-BrAu}"]
["( KBr)",213,212.4036388,-0.5963612,-0.2799817840375587,"{ K I+BrCa- ICa}"]
["(AlCl)",481.77466,480.4195175,-1.3551425,-0.28128139823709286,"{Al S+ClSi- SSi}"]
["( HBi)",1636,1640.6138972,4.6138972,0.28202305623471885,"{ H F+Bi I- F I}"]
["( O P)",1233.34,1236.8184736,3.4784736,0.2820368754763488,"{ OAs+ P P-As P}"]
["(AsAs)",429.55,430.7629391,1.2129391,0.2823743685252008,"{As P+As O- P O}"]
["(NaCs)",98.8786618,99.1582106,0.2795488,0.2827190365555695,"{NaRb+CsLi-RbLi}"]
["( ONa)",492.3,493.7005275,1.4005275,0.284486593540524,"{ OLi+NaBr-LiBr}"]
["( OTe)",797.11,794.8119456,-2.2980544,-0.2882982775275683,"{ OBe+Te S-Be S}"]
["(SeBr)",316.9,315.9818241,-0.9181759,-0.2897367939413064,"{Se S+BrTe- STe}"]
["( HSi)",2042.5229,2048.4522435,5.9293435,0.2902950806573576,"{ HBe+Si O-Be O}"]
["( IBi)",163.8,163.3231841,-0.4768159,-0.29109639804639803,"{ INa+Bi O-Na O}"]
["(SeTe)",316,316.9336076,0.9336076,0.29544544303797465,"{SeSe+Te S-Se S}"]
["(NaBr)",302.1,303.0005567,0.9005567,0.2980988745448527,"{Na O+BrTe- OTe}"]
["(BrPb)",207.5,206.8797303,-0.6202697,-0.29892515662650604,"{BrBi+PbCl-BiCl}"]
["(ClCu)",415.29,414.0467408,-1.2432592,-0.2993713308772183,"{ClAs+Cu H-As H}"]
["( FAs)",685.78,683.7209706,-2.0590294,-0.3002463472250576,"{ F O+As N- O N}"]
["(BeBr)",715,712.8525718,-2.1474282,-0.30033960839160834,"{Be I+BrBi- IBi}"]
["( P P)",780.77,778.4201174,-2.3498826,-0.30096988869961705,"{ P O+ P C- O C}"]
["(NaRb)",106.856,106.5331731,-0.3228269,-0.30211396645953437,"{NaCs+RbLi-CsLi}"]
["(BrSr)",216.5,215.8458064,-0.6541936,-0.3021679445727483,"{Br K+Sr I- K I}"]
["( OSr)",653.49,651.5058075,-1.9841925,-0.30363012440894277,"{ OBi+Sr F-Bi F}"]
["(BrBi)",209.5,208.8637618,-0.6362382,-0.3036936515513126,"{BrAg+Bi H-Ag H}"]
["(BrBi)",209.5,210.1450728,0.6450728,0.30791064439140814,"{BrPb+BiCl-PbCl}"]
["(BrBi)",209.5,208.8544219,-0.6455781,-0.30815183770883053,"{BrSb+BiSb-SbSb}"]
["(Be S)",997.94,994.8430928,-3.0969072,-0.31032999979958714,"{Be O+ S H- O H}"]
["(ClPb)",304,304.9476209,0.9476209,0.31171740131578946,"{ClBi+PbBr-BiBr}"]
["( PAs)",604.04,602.1487302,-1.8912698,-0.31310340374809614,"{ P N+AsCl- NCl}"]
["( ONa)",492.3,490.7541032,-1.5458968,-0.314015193987406,"{ OBi+Na I-Bi I}"]
["( SCa)",462.23,463.6825762,1.4525762,0.3142539861108106,"{ SBi+CaCl-BiCl}"]
["( SPb)",429,430.3498658,1.3498658,0.3146540326340326,"{ S H+Pb O- H O}"]
["( H S)",2696.2475,2704.8161029,8.5686029,0.3177973424175637,"{ H O+ SBe- OBe}"]
["(Cl I)",384,382.7758136,-1.2241864,-0.31879854166666666,"{ClBr+ IBr-BrBr}"]
["(ClBr)",444,442.5809942,-1.4190058,-0.3195959009009009,"{Cl C+Br F- C F}"]
["(AgAu)",198.22,198.8567356,0.6367356,0.321226717788316,"{AgAg+Au H-Ag H}"]
["( FAs)",685.78,687.9874913,2.2074913,0.32189496631572806,"{ F N+As O- N O}"]
["( PAs)",604.04,602.0848066,-1.9551934,-0.32368608039202706,"{ P O+AsAs- OAs}"]
["( HBi)",1636,1641.3552745,5.3552745,0.32733951711491444,"{ HAg+BiBr-AgBr}"]
["(RbRb)",57.7891594,57.979581,0.1904216,0.329510935921314,"{Rb K+Rb K- K K}"]
["(SeTe)",316,314.9576651,-1.0423349,-0.3298528164556962,"{SePb+Te S-Pb S}"]
["(Cu I)",264.5,265.3770735,0.8770735,0.331596786389414,"{CuCl+ IAg-ClAg}"]
["(LiCs)",184.69891,184.0850943,-0.6138157,-0.33233314695793276,"{LiRb+CsNa-RbNa}"]
["(BrAu)",264.4,265.2842935,0.8842935,0.33445291225416035,"{BrCl+AuAg-ClAg}"]
["(ClBi)",308.4,307.3344255,-1.0655745,-0.3455170233463035,"{ClPb+BiBr-PbBr}"]
["(BrAu)",264.4,263.4796442,-0.9203558,-0.34809220877458397,"{BrBr+AuAg-BrAg}"]
["(BrSb)",242.7,243.5449101,0.8449101,0.34812941903584677,"{BrBi+SbSb-BiSb}"]
["(ClAg)",343.49,344.6934855,1.2034855,0.350369879763603,"{ClCu+Ag I-Cu I}"]
["(Cl I)",384,382.6296539,-1.3703461,-0.35686096354166663,"{ClAg+ I F-Ag F}"]
["(SiCl)",535.59,537.5083412,1.9183412,0.3581734535745626,"{Si S+ClAl- SAl}"]
["( FBi)",511,509.1522282,-1.8477718,-0.3615991780821918,"{ F F+Bi S- F S}"]
["(NaRb)",106.856,107.2449526,0.3889526,0.3639969678820094,"{Na K+RbLi- KLi}"]
["( HAg)",1759.7496,1753.3388729,-6.4107271,-0.3642976875800966,"{ HCu+Ag F-Cu F}"]
["(LiRb)",195.1839246,195.8957618,0.7118372,0.36470073109699114,"{LiCs+RbNa-CsNa}"]
["( HAg)",1759.7496,1766.1729286,6.4233286,0.3650137837792376,"{ HAu+AgAg-AuAg}"]
["( HNa)",1171.968,1176.2503251,4.2823251,0.3653960773673001,"{ HCa+NaCl-CaCl}"]
["( HBe)",2061.235,2068.8289468,7.5939468,0.3684173226245431,"{ HBi+Be F-Bi F}"]
["( SBi)",408.71,410.2320614,1.5220614,0.3724062048885518,"{ S F+Bi F- F F}"]
["(AgAg)",192.4,193.1171457,0.7171457,0.3727368503118503,"{AgCu+AgAu-CuAu}"]
["( HAg)",1759.7496,1753.1846034,-6.5649966,-0.37306424732245996,"{ HBi+AgBr-BiBr}"]
["(BrBr)",325.321,326.534706,1.213706,0.37307951223560726,"{BrAg+BrAu-AgAu}"]
["(BrAg)",247.7,246.773331,-0.926669,-0.37410940654016955,"{BrBr+Ag I-Br I}"]
["( OBi)",692.4,695.0178665,2.6178665,0.378085860774119,"{ OSr+Bi F-Sr F}"]
["( SPb)",429,430.6269145,1.6269145,0.37923414918414916,"{ STe+Pb O-Te O}"]
["( SBi)",408.71,407.1585237,-1.5514763,-0.3796032149935162,"{ SCa+BiCl-CaCl}"]
["(BrAu)",264.4,263.3822347,-1.0177653,-0.38493392586989417,"{BrCl+Au F-Cl F}"]
["(SePb)",278,276.9293299,-1.0706701,-0.3851331294964029,"{SeTe+Pb O-Te O}"]
["( HAu)",2305.50082,2296.6131377,-8.8876823,-0.38549898672341393,"{ HAg+AuCu-AgCu}"]
["(Na K)",124.0228834,123.5423058,-0.4805776,-0.3874910716678274,"{NaRb+ KLi-RbLi}"]
["(NaCl)",364.6842,363.2450232,-1.4391768,-0.39463645532216646,"{Na O+Cl N- O N}"]
["( SSr)",388.38,386.8348807,-1.5451193,-0.39783698954632063,"{ SBa+Sr O-Ba O}"]
["(Li O)",814.64,811.39242,-3.24758,-0.398652165373662,"{LiBr+ ONa-BrNa}"]
["( HAg)",1759.7496,1752.6637035,-7.0858965,-0.4026650439357963,"{ H H+Ag O- H O}"]
["( IBa)",152.3,152.9193241,0.6193241,0.40664747209455027,"{ ILi+BaBr-LiBr}"]
["( FAs)",685.78,688.5760593,2.7960593,0.4077195747907493,"{ F S+As S- S S}"]
["( H I)",2309,2299.5764599,-9.4235401,-0.40812213512343004,"{ HBr+ ITe-BrTe}"]
["( SAs)",567.94,565.6202472,-2.3197528,-0.408450329260133,"{ S S+As F- S F}"]
["(Ca I)",238.7,237.7239963,-0.9760037,-0.40888299120234606,"{CaBr+ I K-Br K}"]
["( O F)",1053.0138,1057.3308138,4.3170138,0.4099674477200584,"{ O N+ FAs- NAs}"]
["(Be O)",1487.32,1493.4261672,6.1061672,0.41054831509022943,"{Be S+ OTe- STe}"]
["( STe)",471.18,469.2334828,-1.9465172,-0.41311541236894606,"{ SSe+TeBr-SeBr}"]
["( ONa)",492.3,490.2572417,-2.0427583,-0.4149417631525492,"{ OTe+NaBr-TeBr}"]
["(ClBr)",444,445.875036,1.875036,0.4223054054054054,"{ClCl+BrAu-ClAu}"]
["(BrBr)",325.321,326.6949292,1.3739292,0.42233031375164837,"{Br I+Br H- I H}"]
["(CuAu)",250,251.0578973,1.0578973,0.42315892,"{CuBr+Au H-Br H}"]
["(Mg I)",316,314.6616646,-1.3383354,-0.42352386075949366,"{Mg O+ IBi- OBi}"]
["( SBa)",379.49,381.1055602,1.6155602,0.4257187804685235,"{ SSr+Ba O-Sr O}"]
["( C P)",1239.79924,1245.1115644,5.3123244,0.42848263078464216,"{ C O+ P P- O P}"]
["(LiRb)",195.1839246,194.344857,-0.8390676,-0.4298856074953623,"{Li K+RbNa- KNa}"]
["(Li I)",498.16,496.0069488,-2.1530512,-0.4322007387184841,"{LiBr+ IBa-BrBa}"]
["( C O)",2169.75589,2179.1665744,9.4106844,0.43372088276713927,"{ C F+ O S- F S}"]
["( FBi)",511,513.2251763,2.2251763,0.43545524461839535,"{ FBe+Bi H-Be H}"]
["( OAg)",490.2,492.3615947,2.1615947,0.4409617911056712,"{ O H+Ag H- H H}"]
["(Sr I)",174.1,174.8746793,0.7746793,0.4449622630672027,"{SrBr+ ILi-BrLi}"]
["( HCu)",1941.61045,1950.2699526,8.6595026,0.4459958793485068,"{ HAg+Cu F-Ag F}"]
["(AuAu)",190.9,191.7514603,0.8514603,0.44602425353588265,"{AuBr+AuCl-BrCl}"]
["( STe)",471.18,469.0783128,-2.1016872,-0.4460476251114225,"{ SPb+Te O-Pb O}"]
["( ICs)",119.178,119.7113224,0.5333224,0.44750071321888263,"{ IRb+CsBr-RbBr}"]
["( HBi)",1636,1628.6767003,-7.3232997,-0.44763445599022,"{ HSn+Bi O-Sn O}"]
["(Al S)",617.1169,619.8833628,2.7664628,0.4482882902736905,"{AlCl+ SSi-ClSi}"]
["( HCa)",1298.34,1292.4841222,-5.8558778,-0.4510280666081304,"{ HNa+CaCl-NaCl}"]
["( IBi)",163.8,164.5392296,0.7392296,0.4513001221001221,"{ IMg+Bi O-Mg O}"]
["(SeSe)",385.303,387.0437935,1.7407935,0.4517985844906477,"{Se S+Se S- S S}"]
["(Sr I)",174.1,174.8910677,0.7910677,0.4543754738655945,"{SrCl+ ILi-ClLi}"]
["(ClPb)",304,305.3846236,1.3846236,0.4554682894736842,"{ClBi+Pb F-Bi F}"]
["(Na I)",258,259.1766102,1.1766102,0.4560504651162791,"{Na O+ IMg- OMg}"]
["(SeBr)",316.9,315.4456774,-1.4543226,-0.45892161565162515,"{Se O+BrBe- OBe}"]
["(SbBi)",220,221.0111199,1.0111199,0.4595999545454545,"{SbSb+BiBr-SbBr}"]
["( OCa)",732.1,728.7330994,-3.3669006,-0.4598962710012294,"{ OPb+CaCl-PbCl}"]
["(Li I)",498.16,495.8680076,-2.2919924,-0.460091617151116,"{LiBr+ ISr-BrSr}"]
["( C O)",2169.75589,2159.6577713,-10.0981187,-0.46540344683659324,"{ C P+ OAs- PAs}"]
["( O S)",1150.7913,1156.1568707,5.3655707,0.46625054429938767,"{ O N+ S C- N C}"]
["( HMn)",1548,1555.2310269,7.2310269,0.4671206007751938,"{ HCr+Mn O-Cr O}"]
["(Rb I)",138.51,137.862846,-0.647154,-0.46722547108512025,"{RbBr+ ICs-BrCs}"]
["( H S)",2696.2475,2683.6392241,-12.6082759,-0.46762309098107646,"{ H O+ SPb- OPb}"]
["( F F)",916.929,912.6397902,-4.2892098,-0.4677799262538321,"{ FSi+ F S-Si S}"]
["( H I)",2309,2298.1786966,-10.8213034,-0.46865757470766567,"{ HCl+ IBr-ClBr}"]
["( N F)",1141.37,1136.0205489,-5.3494511,-0.4686868500135802,"{ N O+ FAs- OAs}"]
["( C S)",1285.15464,1279.1240043,-6.0306357,-0.4692537000839059,"{ C N+ S O- N O}"]
["(Li I)",498.16,495.8201874,-2.3398126,-0.4696909828167657,"{LiCl+ ISr-ClSr}"]
["( FPb)",503,500.6317882,-2.3682118,-0.4708174552683897,"{ F O+Pb S- O S}"]
["( FSi)",837.32507,841.2708349,3.9457649,0.47123453499367934,"{ F F+Si S- F S}"]
["(Li K)",212.0386,213.0389522,1.0003522,0.4717783460181307,"{LiRb+ KNa-RbNa}"]
["( FBi)",511,513.4117197,2.4117197,0.47196080234833654,"{ FAs+Bi S-As S}"]
["( F S)",837.6418,833.6878029,-3.9539971,-0.47203913415018206,"{ FAs+ S S-As S}"]
["( SBi)",408.71,406.7728541,-1.9371459,-0.47396586821951997,"{ SAs+Bi F-As F}"]
["(LiCl)",642.95453,639.8946285,-3.0599015,-0.47591258125205216,"{Li O+Cl N- O N}"]
["( HCr)",1581.2,1573.6101677,-7.5898323,-0.4800045724766001,"{ HMn+Cr O-Mn O}"]
["( HLi)",1405.49805,1412.2488355,6.7507855,0.4803126905796846,"{ HGa+Li O-Ga O}"]
["( S S)",725.7102,729.2091471,3.4989471,0.4821410943376571,"{ SAs+ S F-As F}"]
["(BeBr)",715,718.4510177,3.4510177,0.4826598181818182,"{Be O+BrSe- OSe}"]
["(BrAu)",264.4,263.1236793,-1.2763207,-0.4827234114977308,"{BrCl+AuAu-ClAu}"]
["( B N)",840.29472,844.3625429,4.0678229,0.4840947828400017,"{ B H+ N F- H F}"]
["(ClCu)",415.29,413.2738758,-2.0161242,-0.485473813479737,"{Cl H+CuAg- HAg}"]
["(CuBr)",314.8,313.2704489,-1.5295511,-0.48588027318932653,"{CuAu+Br H-Au H}"]
["( HAg)",1759.7496,1751.1743085,-8.5752915,-0.4873018013471917,"{ H F+AgAg- FAg}"]
["( HBr)",2649,2661.9369063,12.9369063,0.4883694337485844,"{ HAg+BrCu-AgCu}"]
["(ClBi)",308.4,306.8887037,-1.5112963,-0.490044195849546,"{ClPb+Bi F-Pb F}"]
["( HLi)",1405.49805,1412.3980696,6.9000196,0.49093057083928365,"{ HAl+Li O-Al O}"]
["(Si S)",749.64559,745.9652478,-3.6803422,-0.4909442874198726,"{Si F+ S F- F F}"]
["( C S)",1285.15464,1278.8299214,-6.3247186,-0.49213677507323167,"{ CCl+ SAs-ClAs}"]
["(BrBa)",193.8,192.8438119,-0.9561881,-0.4933891124871001,"{BrLi+Ba I-Li I}"]
["(AgAu)",198.22,197.2408448,-0.9791552,-0.49397396831803053,"{AgCl+Au F-Cl F}"]
["( SGe)",575.8,578.6446296,2.8446296,0.49403084404307057,"{ SSi+Ge O-Si O}"]
["( ONa)",492.3,494.7399169,2.4399169,0.4956158643103798,"{ O N+NaCl- NCl}"]
["( F S)",837.6418,841.8038977,4.1620977,0.4968827606263203,"{ F F+ SSi- FSi}"]
["( HSn)",1715,1723.525522,8.525522,0.4971149854227405,"{ HBi+Sn O-Bi O}"]
["( OAs)",967.08,962.2664687,-4.8135313,-0.4977386875956487,"{ O P+AsAs- PAs}"]
["(NaCl)",364.6842,362.8545209,-1.8296791,-0.5017160326660711,"{Na H+ClCa- HCa}"]
["(RbCs)",50.0137382,50.2669475,0.2532093,0.5062794926214894,"{RbRb+Cs K-Rb K}"]
["(BrRb)",169.46,170.3180586,0.8580586,0.5063487548684055,"{BrCa+RbCl-CaCl}"]
["( FAg)",513.447,516.053652,2.606652,0.5076769364705607,"{ FCu+Ag H-Cu H}"]
["( SPb)",429,431.1870147,2.1870147,0.5097936363636364,"{ S O+Pb F- O F}"]
["(ClCu)",415.29,417.4184815,2.1284815,0.512528955669532,"{ClBr+CuBr-BrBr}"]
["(SePb)",278,279.4371136,1.4371136,0.5169473381294964,"{SeSe+Pb S-Se S}"]
["(CaBr)",285.3,286.7749918,1.4749918,0.5169967753242201,"{Ca I+Br K- I K}"]
["( O P)",1233.34,1239.726374,6.386374,0.5178113091280588,"{ O C+ P P- C P}"]
["( SSn)",487,484.4777795,-2.5222205,-0.5179097535934292,"{ SBe+Sn O-Be O}"]
["( OPb)",721,717.2421817,-3.7578183,-0.5211953259361998,"{ O H+Pb S- H S}"]
["(BrSr)",216.5,217.6359771,1.1359771,0.5247007390300231,"{BrLi+Sr F-Li F}"]
["( SSe)",555.56,558.5050915,2.9450915,0.5301122291021673,"{ SPb+SeSe-PbSe}"]
["(BrCs)",149.66,148.8661748,-0.7938252,-0.5304190832553788,"{BrRb+Cs I-Rb I}"]
["(ClAu)",383.6,381.5472737,-2.0527263,-0.5351215589155369,"{ClBr+AuAu-BrAu}"]
["(AsSb)",343,344.8481189,1.8481189,0.5388101749271137,"{AsAs+Sb P-As P}"]
["( H I)",2309,2321.4699262,12.4699262,0.5400574361195323,"{ HBr+ IBr-BrBr}"]
["(Te I)",217,218.1739244,1.1739244,0.5409789861751152,"{TeBr+ IBr-BrBr}"]
["(LiBr)",563.1,560.0522876,-3.0477124,-0.5412382170129639,"{Li F+BrSr- FSr}"]
["( KCs)",68.394,68.0232998,-0.3707002,-0.5420069011901628,"{ KRb+CsRb-RbRb}"]
["(BrSr)",216.5,215.3246775,-1.1753225,-0.5428741339491917,"{BrLi+Sr I-Li I}"]
["(LiBr)",563.1,566.1579933,3.0579933,0.5430639850825786,"{Li I+BrBa- IBa}"]
["(ClAg)",343.49,345.3559978,1.8659978,0.5432466156219976,"{ClBr+AgBr-BrBr}"]
["( SPb)",429,431.3367875,2.3367875,0.5447057109557109,"{ SBe+Pb O-Be O}"]
["(RbRb)",57.7891594,57.474082,-0.3150774,-0.5452188667759026,"{Rb K+RbCs- KCs}"]
["(CuAg)",231.8,230.5358145,-1.2641855,-0.5453776962899051,"{Cu H+AgCl- HCl}"]
["( FAu)",563.697,566.772687,3.075687,0.5456277042453659,"{ FCl+AuBr-ClBr}"]
["(ClRb)",228,226.7543181,-1.2456819,-0.5463517105263158,"{ClCa+RbBr-CaBr}"]
["(ClBr)",444,441.5681824,-2.4318176,-0.5477066666666667,"{ClCl+Br H-Cl H}"]
["( OAs)",967.08,961.7659291,-5.3140709,-0.5494965152831203,"{ O N+As F- N F}"]
["( HBr)",2649,2663.5741858,14.5741858,0.5501768893922234,"{ H I+BrTe- ITe}"]
["(Si S)",749.64559,745.5143177,-4.1312723,-0.5510967255873539,"{Si O+ SGe- OGe}"]
["(Ag I)",206.52,205.3796414,-1.1403586,-0.5521782878171605,"{Ag H+ I H- H H}"]
["( H B)",2366.7296,2353.4865021,-13.2430979,-0.5595526375298641,"{ H F+ B N- F N}"]
["(BrBi)",209.5,210.6740273,1.1740273,0.560394892601432,"{BrCu+Bi H-Cu H}"]
["(AgAu)",198.22,197.1072341,-1.1127659,-0.5613792251034205,"{AgCl+AuAu-ClAu}"]
["(BrRb)",169.46,170.4278165,0.9678165,0.5711179629411071,"{BrCs+Rb I-Cs I}"]
["( OPb)",721,725.1226015,4.1226015,0.5717893897364771,"{ OTe+PbSe-TeSe}"]
["(Be O)",1487.32,1495.8380482,8.5180482,0.5727111986660571,"{Be S+ O H- S H}"]
["(ClAg)",343.49,345.4586883,1.9686883,0.573142828029928,"{Cl F+AgAu- FAu}"]
["( NAs)",1068.54,1074.6834882,6.1434882,0.5749422763771128,"{ N O+As F- O F}"]
["(CuAg)",231.8,233.1332695,1.3332695,0.5751809749784297,"{CuCl+Ag H-Cl H}"]
["( OPb)",721,725.149785,4.149785,0.5755596393897364,"{ OCa+PbCl-CaCl}"]
["(ClAg)",343.49,345.4709227,1.9809227,0.5767046202218404,"{ClCu+AgBr-CuBr}"]
["(CuAg)",231.8,230.4596435,-1.3403565,-0.57823835202761,"{Cu H+AgBr- HBr}"]
["(LiBr)",563.1,566.358429,3.258429,0.5786590303676078,"{Li I+BrSr- ISr}"]
["( IBa)",152.3,153.1859033,0.8859033,0.5816830597504924,"{ ICa+BaBr-CaBr}"]
["( H O)",3737.761,3715.9075241,-21.8534759,-0.5846675563258324,"{ H S+ OBe- SBe}"]
["( HBi)",1636,1626.3784762,-9.6215238,-0.5881127017114914,"{ HCu+BiBr-CuBr}"]
["(NaBr)",302.1,303.888093,1.788093,0.5918877855014895,"{NaCl+BrCa-ClCa}"]
["(BrAg)",247.7,249.1690778,1.4690778,0.5930875252321357,"{BrCu+AgCl-CuCl}"]
["( PSb)",500.07,497.0689144,-3.0010856,-0.6001331013658088,"{ PAs+SbAs-AsAs}"]
["( KRb)",75.8418,76.2976014,0.4558014,0.6009896917003552,"{ KCs+RbRb-CsRb}"]
["(ClSr)",302.3,304.1214413,1.8214413,0.6025277208071452,"{ClLi+Sr F-Li F}"]
["(ClAs)",443,440.328481,-2.671519,-0.6030516930022574,"{Cl N+AsAs- NAs}"]
["(CuAg)",231.8,230.3853274,-1.4146726,-0.6102987920621225,"{Cu I+Ag H- I H}"]
["(Ca I)",238.7,240.1618708,1.4618708,0.6124301633850021,"{CaBr+ IMg-BrMg}"]
["( K I)",186.53,187.6781698,1.1481698,0.6155416286924356,"{ KBr+ IMg-BrMg}"]
["( OPb)",721,716.5564049,-4.4435951,-0.6163099999999999,"{ OTe+Pb S-Te S}"]
["(BrTe)",267.4,265.7490776,-1.6509224,-0.6173980553477936,"{BrBr+Te I-Br I}"]
["(Be S)",997.94,1004.101556,6.161556,0.6174275006513418,"{Be O+ SSn- OSn}"]
["( HAu)",2305.50082,2291.2074575,-14.2933625,-0.619967790772679,"{ HAg+AuAg-AgAg}"]
["(ClBr)",444,441.2409493,-2.7590507,-0.6214078153153153,"{ClCl+BrAg-ClAg}"]
["(BrAg)",247.7,249.2434435,1.5434435,0.6231100121114251,"{BrBr+AgCl-BrCl}"]
["(NaCs)",98.8786618,99.4947981,0.6161363,0.6231236232203943,"{Na K+CsLi- KLi}"]
["(Sr I)",174.1,175.1879837,1.0879837,0.6249188397472718,"{SrBr+ ICa-BrCa}"]
["(LiCl)",642.95453,638.9358407,-4.0186893,-0.6250347594564736,"{Li F+ClSr- FSr}"]
["( SAs)",567.94,571.4906549,3.5506549,0.6251813395781244,"{ SSi+As O-Si O}"]
["( FBi)",511,507.8017714,-3.1982286,-0.6258764383561645,"{ FSi+Bi S-Si S}"]
["(AuAu)",190.9,192.1050597,1.2050597,0.6312518072289157,"{AuCl+AuCl-ClCl}"]
["(LiBr)",563.1,566.6602705,3.5602705,0.632262564375777,"{Li O+BrTe- OTe}"]
["( HNa)",1171.968,1179.4089677,7.4409677,0.6349121904352337,"{ HMn+Na O-Mn O}"]
["(BrTe)",267.4,265.7018572,-1.6981428,-0.635057142857143,"{BrNa+Te O-Na O}"]
["(CuAu)",250,248.4011301,-1.5988699,-0.63954796,"{Cu I+Au H- I H}"]
["( S S)",725.7102,730.3768051,4.6666051,0.6430397560899654,"{ SSe+ SSe-SeSe}"]
["(Cu I)",264.5,266.2027113,1.7027113,0.6437471833648394,"{CuAu+ I H-Au H}"]
["(CuBr)",314.8,316.828152,2.028152,0.644266836086404,"{CuCl+BrAg-ClAg}"]
["( F F)",916.929,922.8404937,5.9114937,0.644705718763394,"{ FBi+ F S-Bi S}"]
["(Ca I)",238.7,237.1601261,-1.5398739,-0.6451084625052367,"{CaBr+ IBa-BrBa}"]
["(ClAu)",383.6,381.125182,-2.474818,-0.6451558915537017,"{ClCl+Au F-Cl F}"]
["(Li O)",814.64,819.9225036,5.2825036,0.648446381223608,"{LiCl+ O N-Cl N}"]
["(ClSr)",302.3,300.3378599,-1.9621401,-0.6490704928878597,"{ClLi+Sr I-Li I}"]
["( F I)",610,613.9620651,3.9620651,0.6495188688524589,"{ F H+ IBi- HBi}"]
["( SBi)",408.71,411.365953,2.655953,0.6498380269628832,"{ SSi+Bi F-Si F}"]
["(BrAg)",247.7,249.3103366,1.6103366,0.6501157044812272,"{Br I+Ag F- I F}"]
["(ClAg)",343.49,345.7322609,2.2422609,0.6527878249730705,"{ClAu+AgAu-AuAu}"]
["( O P)",1233.34,1241.4697438,8.1297438,0.6591648531629559,"{ OAs+ PAs-AsAs}"]
["(NaCl)",364.6842,362.2791299,-2.4050701,-0.6594939128155265,"{NaBr+ClCa-BrCa}"]
["( OSr)",653.49,657.8064066,4.3164066,0.6605160905293118,"{ OBa+Sr S-Ba S}"]
["( F S)",837.6418,832.0976714,-5.5441286,-0.6618734404133126,"{ F F+ SBi- FBi}"]
["(Si S)",749.64559,744.6728007,-4.9727893,-0.6633520381277771,"{SiCl+ SAl-ClAl}"]
["( FCu)",622.65,618.5180479,-4.1319521,-0.663607500200755,"{ FAg+Cu H-Ag H}"]
["( SPb)",429,426.1509282,-2.8490718,-0.6641193006993007,"{ SSe+PbSe-SeSe}"]
["(AsSb)",343,345.2886075,2.2886075,0.6672325072886297,"{As P+Sb P- P P}"]
["( FAg)",513.447,510.0148703,-3.4321297,-0.6684486811686503,"{ F H+AgAg- HAg}"]
["(AsAs)",429.55,426.6633681,-2.8866319,-0.6720130136189034,"{As P+AsSb- PSb}"]
["( OTe)",797.11,791.7435619,-5.3664381,-0.6732368305503632,"{ OPb+TeSe-PbSe}"]
["(Ca I)",238.7,237.0906997,-1.6093003,-0.6741936740678676,"{CaBr+ ISr-BrSr}"]
["(ClAg)",343.49,341.1733446,-2.3166554,-0.6744462429765059,"{ClAu+AgBr-AuBr}"]
["(SeTe)",316,318.1319328,2.1319328,0.6746622784810127,"{Se S+Te S- S S}"]
["( HAu)",2305.50082,2321.1480111,15.6471911,0.6786894614940974,"{ H N+Au F- N F}"]
["(CuAu)",250,248.298365,-1.701635,-0.680654,"{Cu I+AuAu- IAu}"]
["(Al S)",617.1169,621.3287156,4.2118156,0.6824988263973975,"{Al F+ SBe- FBe}"]
["( N P)",1336.948,1346.1079524,9.1599524,0.6851390181218715,"{ NCl+ PAs-ClAs}"]
["( HGa)",1605,1593.9964193,-11.0035807,-0.6855813520249222,"{ HLi+Ga O-Li O}"]
["(Cu I)",264.5,266.3144169,1.8144169,0.6859799243856334,"{CuAu+ IAu-AuAu}"]
["( HBr)",2649,2630.8062163,-18.1937837,-0.6868170517176293,"{ H I+BrBr- IBr}"]
["( FAu)",563.697,559.8249816,-3.8720184,-0.6868971096174009,"{ F N+Au H- N H}"]
["( STe)",471.18,474.4169656,3.2369656,0.6869912984422089,"{ SSn+Te O-Sn O}"]
["( KBr)",213,211.5330448,-1.4669552,-0.6887113615023474,"{ K I+BrMg- IMg}"]
["(CuBr)",314.8,312.6273658,-2.1726342,-0.6901633418043203,"{CuCl+Br I-Cl I}"]
["(ClAg)",343.49,345.8755887,2.3855887,0.6945147456985646,"{Cl I+Ag F- I F}"]
["(Mg I)",316,313.7978526,-2.2021474,-0.6968820886075949,"{Mg O+ INa- ONa}"]
["(ClCa)",367.53,370.0937777,2.5637777,0.6975696405735587,"{ClNa+Ca H-Na H}"]
["(Mg I)",316,313.7926736,-2.2073264,-0.6985210126582277,"{MgBr+ ICa-BrCa}"]
["(Br I)",269,270.8810941,1.8810941,0.6992914869888477,"{BrCl+ I H-Cl H}"]
["(LiCl)",642.95453,647.4542421,4.4997121,0.6998491946234519,"{Li I+ClSr- ISr}"]
["(CuBr)",314.8,317.003138,2.203138,0.6998532401524777,"{CuCl+Br H-Cl H}"]
["(BrBa)",193.8,192.4400876,-1.3599124,-0.7017091847265222,"{BrCa+Ba I-Ca I}"]
["( HAg)",1759.7496,1772.1197438,12.3701438,0.7029490900296268,"{ H H+Ag I- H I}"]
["( FAg)",513.447,517.0617978,3.6147978,0.7040254982500628,"{ F I+AgBr- IBr}"]
["( SSn)",487,483.5638237,-3.4361763,-0.7055803490759753,"{ STe+Sn O-Te O}"]
["(Na K)",124.0228834,123.1437049,-0.8791785,-0.7088840993677462,"{NaCs+ KLi-CsLi}"]
["(Si S)",749.64559,744.316868,-5.328722,-0.7108321680382326,"{Si O+ SAs- OAs}"]
["(SeTe)",316,313.7460422,-2.2539578,-0.7132777848101265,"{SePb+Te O-Pb O}"]
["(BrAg)",247.7,245.928297,-1.771703,-0.7152616067823981,"{Br H+Ag H- H H}"]
["(Cl I)",384,381.2400264,-2.7599736,-0.718743125,"{ClBr+ I H-Br H}"]
["( OBa)",669.76,664.9392999,-4.8207001,-0.7197653039894888,"{ OSr+Ba S-Sr S}"]
["(ClBr)",444,447.1990629,3.1990629,0.7205096621621622,"{ClCu+BrBr-CuBr}"]
["(BrTe)",267.4,265.4719713,-1.9280287,-0.7210279356768886,"{BrSe+TeSe-SeSe}"]
["( OTe)",797.11,802.8577232,5.7477232,0.7210702663371429,"{ OPb+Te S-Pb S}"]
["(LiCs)",184.69891,183.3608323,-1.3380777,-0.7244643187120053,"{Li K+CsNa- KNa}"]
["( FAs)",685.78,680.7976137,-4.9823863,-0.7265283764472571,"{ FBi+As S-Bi S}"]
["( H O)",3737.761,3765.015696,27.254696,0.7291717153664988,"{ HAg+ O O-Ag O}"]
["(SePb)",278,275.9677868,-2.0322132,-0.7310119424460433,"{SeTe+Pb S-Te S}"]
["(BrBr)",325.321,327.7016569,2.3806569,0.731787034959317,"{BrCl+BrAg-ClAg}"]
["(BiBi)",172.71,173.9746621,1.2646621,0.7322460193387759,"{Bi F+Bi S- F S}"]
["( SBi)",408.71,405.7158381,-2.9941619,-0.7325883633872428,"{ S S+Bi F- S F}"]
["( FCl)",783.4534,777.698497,-5.754903,-0.7345558778607636,"{ FAu+ClBr-AuBr}"]
["( FBi)",511,514.7569788,3.7569788,0.7352209001956947,"{ F S+Bi S- S S}"]
["(Ag I)",206.52,208.0480564,1.5280564,0.7399072244818904,"{Ag F+ ICu- FCu}"]
["( PSb)",500.07,496.3685676,-3.7014324,-0.7401828544003839,"{ P P+SbAs- PAs}"]
["(SeSe)",385.303,382.4408957,-2.8621043,-0.7428191060022891,"{Se S+SePb- SPb}"]
["(SeSe)",385.303,382.4408957,-2.8621043,-0.7428191060022891,"{SePb+Se S-Pb S}"]
["( HAu)",2305.50082,2288.3603158,-17.1405042,-0.743461205969122,"{ HBr+AuCu-BrCu}"]
["(ClAu)",383.6,380.7380576,-2.8619424,-0.7460746611053181,"{Cl N+Au F- N F}"]
["(CaBr)",285.3,283.1652679,-2.1347321,-0.7482411847178407,"{Ca I+BrMg- IMg}"]
["(BrBr)",325.321,327.7599383,2.4389383,0.7497020788697931,"{Br I+BrTe- ITe}"]
["( SAs)",567.94,572.2184797,4.2784797,0.7533330457442687,"{ SBi+As F-Bi F}"]
["(AuAu)",190.9,192.3408065,1.4408065,0.7547441068622316,"{AuCl+AuAg-ClAg}"]
["( H H)",4401.21,4434.4799286,33.2699286,0.7559268610223098,"{ H O+ H O- O O}"]
["(BrSr)",216.5,214.859104,-1.640896,-0.7579196304849883,"{BrCa+Sr I-Ca I}"]
["(CuBr)",314.8,312.4133117,-2.3866883,-0.7581601969504447,"{Cu H+BrBi- HBi}"]
["( FSi)",837.32507,843.6739476,6.3488776,0.7582333107499099,"{ F C+Si N- C N}"]
["(LuLu)",121.6,122.524156,0.924156,0.7599967105263159,"{Lu H+Lu H- H H}"]
["(AgAu)",198.22,199.7275723,1.5075723,0.7605550903037029,"{Ag F+Au H- F H}"]
["( HAl)",1682.37474,1669.5713736,-12.8033664,-0.7610294006197454,"{ HLi+Al O-Li O}"]
["(ClCu)",415.29,412.1243918,-3.1656082,-0.7622644898745454,"{Cl H+CuAu- HAu}"]
["( SSr)",388.38,385.417713,-2.962287,-0.7627290282712808,"{ SCa+Sr F-Ca F}"]
["(AsSb)",343,345.6224114,2.6224114,0.7645514285714285,"{As O+Sb P- O P}"]
["(Be S)",997.94,990.2850493,-7.6549507,-0.7670752450047096,"{Be O+ SPb- OPb}"]
["(CuBr)",314.8,312.3827087,-2.4172913,-0.7678816073697586,"{Cu F+BrAg- FAg}"]
["( SPb)",429,432.2998465,3.2998465,0.7691949883449883,"{ STe+PbSe-TeSe}"]
["(AsAs)",429.55,426.2457699,-3.3042301,-0.7692306134326621,"{As P+As F- P F}"]
["( FPb)",503,499.1276152,-3.8723848,-0.7698578131212723,"{ FBi+PbCl-BiCl}"]
["(CaBr)",285.3,283.1012702,-2.1987298,-0.7706729057132843,"{CaCl+BrNa-ClNa}"]
["(ClAg)",343.49,340.8410561,-2.6489439,-0.7711851582287693,"{Cl O+AgAg- OAg}"]
["(Li I)",498.16,502.0092104,3.8492104,0.7726855628713666,"{LiBr+ IMg-BrMg}"]
["(ClCl)",559.751,555.4049524,-4.3460476,-0.776425160473139,"{Cl F+Cl H- F H}"]
["( SCa)",462.23,458.6315466,-3.5984534,-0.7784984531510286,"{ SBe+Ca F-Be F}"]
["( SSn)",487,483.207305,-3.792695,-0.7787874743326489,"{ S H+Sn O- H O}"]
["(ClBr)",444,440.5410338,-3.4589662,-0.7790464414414414,"{ClAu+BrAg-AuAg}"]
["(AgAg)",192.4,193.9051094,1.5051094,0.782281392931393,"{Ag F+Ag H- F H}"]
["( ONa)",492.3,488.4119924,-3.8880076,-0.7897638838106844,"{ OMg+Na I-Mg I}"]
["(BrAu)",264.4,262.3063306,-2.0936694,-0.7918568078668685,"{Br H+AuCl- HCl}"]
["(AsAs)",429.55,432.962443,3.412443,0.7944227680130369,"{AsSb+AsSb-SbSb}"]
["( PAs)",604.04,608.8400252,4.8000252,0.7946535328786175,"{ PSb+AsAs-SbAs}"]
["( FBi)",511,515.0745745,4.0745745,0.797372700587084,"{ FPb+BiCl-PbCl}"]
["( NCl)",827.95767,821.3546229,-6.6030471,-0.7975102277873699,"{ N H+Cl O- H O}"]
["(BrBr)",325.321,327.9199198,2.5989198,0.7988785845365038,"{Br H+BrCl- HCl}"]
["(ClSb)",374.7,371.6895492,-3.0104508,-0.8034296236989593,"{ClSi+Sb O-Si O}"]
["( HCl)",2990.9,3014.963567,24.063567,0.8045593968370724,"{ H I+ClBr- IBr}"]
["( NCl)",827.95767,821.2406461,-6.7170239,-0.8112762455597519,"{ N F+Cl H- F H}"]
["(RbCs)",50.0137382,50.4198232,0.4060851,0.8119471061653215,"{Rb K+Cs K- K K}"]
["( FAs)",685.78,691.3502319,5.5702319,0.8122476450173525,"{ F P+AsAs- PAs}"]
["(ClAg)",343.49,346.2825267,2.7925267,0.8129863169233457,"{Cl H+AgCu- HCu}"]
["(AgAu)",198.22,196.6013223,-1.6186777,-0.8166066491776816,"{AgBr+AuCl-BrCl}"]
["( HAg)",1759.7496,1745.3508926,-14.3987074,-0.8182247860718365,"{ HCl+AgCu-ClCu}"]
["( IAu)",215.77,214.0033027,-1.7666973,-0.8187872734856559,"{ ICu+AuAu-CuAu}"]
["(CaBr)",285.3,287.6460877,2.3460877,0.8223230634419909,"{Ca I+BrBa- IBa}"]
["(ClCl)",559.751,564.3792544,4.6282544,0.8268416492333199,"{ClAu+Cl F-Au F}"]
["( OAg)",490.2,486.1381525,-4.0618475,-0.8286102611179111,"{ OCl+AgAg-ClAg}"]
["(ClAg)",343.49,340.643166,-2.846834,-0.8287967626422893,"{ClCl+AgBr-ClBr}"]
["( HCu)",1941.61045,1957.7353795,16.1249295,0.8304925171782014,"{ HAs+CuCl-AsCl}"]
["( FAu)",563.697,568.381599,4.684599,0.8310491274567721,"{ FCl+AuCl-ClCl}"]
["(Rb I)",138.51,139.6621534,1.1521534,0.8318196520106852,"{RbBr+ INa-BrNa}"]
["( OGe)",985.5,977.2635193,-8.2364807,-0.8357666869609336,"{ OSi+Ge S-Si S}"]
["(Cu I)",264.5,266.7123612,2.2123612,0.8364314555765596,"{CuBr+ ITe-BrTe}"]
["( HCu)",1941.61045,1957.859963,16.249513,0.8369090205504406,"{ HBi+CuBr-BiBr}"]
["(Te I)",217,215.1820294,-1.8179706,-0.837774470046083,"{TeBr+ ICu-BrCu}"]
["(Be S)",997.94,989.5758743,-8.3641257,-0.8381391366214401,"{Be F+ SAl- FAl}"]
["( SCa)",462.23,466.1051895,3.8751895,0.8383682365921727,"{ SSr+Ca F-Sr F}"]
["(AuAu)",190.9,192.5005382,1.6005382,0.8384170770036667,"{Au I+AuCu- ICu}"]
["(SeBr)",316.9,319.5570019,2.6570019,0.838435437046387,"{SeSe+BrTe-SeTe}"]
["( OSn)",823,829.9526023,6.9526023,0.8447876427703523,"{ OBe+Sn S-Be S}"]
["( PSb)",500.07,495.8415826,-4.2284174,-0.8455651008858759,"{ P O+SbAs- OAs}"]
["(CsCs)",42.022,42.3775436,0.3555436,0.8460891913759461,"{CsRb+CsRb-RbRb}"]
["( O F)",1053.0138,1061.9747465,8.9609465,0.8509809178189309,"{ OAs+ F N-As N}"]
["(BrAu)",264.4,262.1468034,-2.2531966,-0.8521923600605145,"{BrAg+AuCl-AgCl}"]
["( OPb)",721,714.8141728,-6.1858272,-0.857951067961165,"{ OBe+Pb S-Be S}"]
["( H B)",2366.7296,2346.4133451,-20.3162549,-0.8584104791692299,"{ H O+ B B- O B}"]
["( FAl)",802.32447,795.4339229,-6.8905471,-0.8588230021203267,"{ FBe+Al S-Be S}"]
["(Cu I)",264.5,262.2277806,-2.2722194,-0.8590621550094518,"{Cu F+ IAg- FAg}"]
["(CaBr)",285.3,287.7543234,2.4543234,0.8602605678233437,"{Ca I+BrSr- ISr}"]
["( KCs)",68.394,67.8050375,-0.5889625,-0.8611318244290435,"{ K K+CsRb- KRb}"]
["(SePb)",278,280.3949663,2.3949663,0.8614986690647481,"{Se S+Pb S- S S}"]
["(Cu I)",264.5,266.7819456,2.2819456,0.8627393572778826,"{CuAg+ I H-Ag H}"]
["(BrAg)",247.7,249.839512,2.139512,0.8637513120710536,"{BrBr+AgAu-BrAu}"]
["(Br I)",269,266.6752929,-2.3247071,-0.8642033828996282,"{BrCl+ IAg-ClAg}"]
["( STe)",471.18,467.1005348,-4.0794652,-0.8657976144997664,"{ SPb+TeSe-PbSe}"]
["(Ag I)",206.52,204.7241554,-1.7958446,-0.8695741816773193,"{Ag O+ I H- O H}"]
["( FSr)",502.4,506.7785989,4.3785989,0.8715364052547772,"{ FCa+Sr S-Ca S}"]
["(BrBr)",325.321,322.4840833,-2.8369167,-0.872036142763609,"{BrCl+Br I-Cl I}"]
["(Li K)",212.0386,213.8885643,1.8499643,0.8724658151864801,"{LiCs+ KNa-CsNa}"]
["(Br I)",269,266.6500717,-2.3499283,-0.8735792936802975,"{BrPb+ ICl-PbCl}"]
["(Sr I)",174.1,175.6212088,1.5212088,0.8737557725445146,"{Sr F+ ILi- FLi}"]
["( CCl)",876.89749,884.5611996,7.6637096,0.8739572968785667,"{ C H+Cl H- H H}"]
["(Li O)",814.64,807.5121887,-7.1278113,-0.8749645610330944,"{Li H+ OGa- HGa}"]
["( N O)",1904.1346,1887.4523327,-16.6822673,-0.8761075661352931,"{ N C+ O S- C S}"]
["( HMg)",1492.7763,1479.631354,-13.144946,-0.8805703841895132,"{ HCr+Mg O-Cr O}"]
["( HMg)",1492.7763,1505.9397859,13.1634859,0.8818123586233249,"{ HIn+Mg O-In O}"]
["(Ag I)",206.52,208.3453751,1.8253751,0.8838732810381561,"{AgBr+ ITe-BrTe}"]
["(Na I)",258,255.7107574,-2.2892426,-0.8873033333333333,"{Na H+ ILi- HLi}"]
["( HLi)",1405.49805,1417.9722369,12.4741869,0.8875278695690827,"{ HMg+LiBr-MgBr}"]
["( H O)",3737.761,3771.0249224,33.2639224,0.8899424655562513,"{ H S+ OPb- SPb}"]
["(Li I)",498.16,493.717018,-4.442982,-0.8918785129275735,"{Li F+ ISr- FSr}"]
["(Be F)",1247.36,1236.2247933,-11.1352067,-0.892701922460236,"{Be H+ FBi- HBi}"]
["(SiCl)",535.59,540.3768262,4.7868262,0.8937482402584065,"{Si N+ClAs- NAs}"]
["(Li O)",814.64,807.357865,-7.282135,-0.8939083521555533,"{Li H+ OAl- HAl}"]
["( HMg)",1492.7763,1479.4246907,-13.3516093,-0.8944146085384661,"{ HPb+Mg S-Pb S}"]
["(Ag I)",206.52,208.3673975,1.8473975,0.8945368487313577,"{AgCl+ IBr-ClBr}"]
["(NaCl)",364.6842,361.4200978,-3.2641022,-0.8950489766214166,"{Na O+Cl C- O C}"]
["(ClAu)",383.6,380.1612401,-3.4387599,-0.8964441866527633,"{ClAg+AuAu-AgAu}"]
["(BrPb)",207.5,209.3617356,1.8617356,0.8972219759036145,"{Br I+PbCl- ICl}"]
["(Rb I)",138.51,139.7547673,1.2447673,0.8986840661324093,"{RbCl+ INa-ClNa}"]
["( HNa)",1171.968,1182.5194016,10.5514016,0.9003148208824814,"{ HCr+Na O-Cr O}"]
["(ClAu)",383.6,387.0565898,3.4565898,0.9010922314911365,"{Cl H+AuBr- HBr}"]
["( F P)",846.75,839.110688,-7.639312,-0.9021921464422794,"{ F N+ P O- N O}"]
["( NCl)",827.95767,835.4393621,7.4816921,0.9036321989746167,"{ NAs+ClAs-AsAs}"]
["( N F)",1141.37,1131.0522147,-10.3177853,-0.9039825210054584,"{ NAs+ F O-As O}"]
["( H C)",2860.7508,2834.8545658,-25.8962342,-0.9052250968521971,"{ H H+ CCl- HCl}"]
["( HAg)",1759.7496,1775.7090531,15.9594531,0.9069161373868191,"{ H I+AgCu- ICu}"]
["(ClAg)",343.49,340.3620365,-3.1279635,-0.9106417945209466,"{Cl F+Ag O- F O}"]
["(CaBr)",285.3,282.7002708,-2.5997292,-0.9112264984227129,"{CaCl+BrRb-ClRb}"]
["(AsAs)",429.55,433.4645866,3.9145866,0.9113226865324175,"{As N+AsCl- NCl}"]
["(BrAg)",247.7,249.9602448,2.2602448,0.9124928542591846,"{BrCu+Ag I-Cu I}"]
["( PAs)",604.04,609.552154,5.512154,0.9125478445136084,"{ P F+AsAs- FAs}"]
["(ClAs)",443,438.9560776,-4.0439224,-0.9128493002257334,"{ClSi+As N-Si N}"]
["(MgBr)",373.8,377.2130122,3.4130122,0.9130583734617441,"{Mg I+BrCa- ICa}"]
["( FCa)",581.1,586.4166501,5.3166501,0.9149286009292721,"{ FBe+Ca S-Be S}"]
["( C N)",2068.648,2087.6667696,19.0187696,0.9193816251000653,"{ C S+ N O- S O}"]
["(Mg I)",316,313.0937738,-2.9062262,-0.9196918354430379,"{MgBr+ ILi-BrLi}"]
["(SbSb)",269.98,272.4635464,2.4835464,0.9199001407511667,"{SbAs+SbAs-AsAs}"]
["(Be O)",1487.32,1501.0140765,13.6940765,0.9207215999246967,"{Be H+ OSi- HSi}"]
["(ClCa)",367.53,370.9193575,3.3893575,0.9221988681196093,"{ClNa+CaBr-NaBr}"]
["( HIn)",1524,1509.9133753,-14.0866247,-0.9243192060367453,"{ HMg+In O-Mg O}"]
["(CuAg)",231.8,233.946091,2.146091,0.925837359792925,"{CuAu+Ag I-Au I}"]
["( FAg)",513.447,508.6863828,-4.7606172,-0.9271876552010238,"{ F I+AgCl- ICl}"]
["(Ag I)",206.52,204.6012614,-1.9187386,-0.9290812512105364,"{AgBr+ I I-Br I}"]
["(LiBr)",563.1,557.8485132,-5.2514868,-0.9326028769312733,"{Li I+BrMg- IMg}"]
["( HNa)",1171.968,1182.9066349,10.9386349,0.9333561069926823,"{ HLi+Na I-Li I}"]
["( FCa)",581.1,575.6646401,-5.4353599,-0.9353570641886078,"{ FSr+Ca S-Sr S}"]
["( HAg)",1759.7496,1743.2844615,-16.4651385,-0.935652350766268,"{ HAs+AgCl-AsCl}"]
["(BrSr)",216.5,218.5289039,2.0289039,0.9371380600461894,"{BrCa+SrCl-CaCl}"]
["( F P)",846.75,838.8140987,-7.9359013,-0.9372189312075584,"{ FAs+ PAs-AsAs}"]
["( KRb)",75.8418,75.130762,-0.711038,-0.9375278540330002,"{ K K+RbCs- KCs}"]
["(Ag I)",206.52,204.5831542,-1.9368458,-0.9378490218865001,"{AgAg+ IAu-AgAu}"]
["(Na I)",258,255.5801078,-2.4198922,-0.9379427131782947,"{Na H+ IMg- HMg}"]
["( FAg)",513.447,508.626898,-4.820102,-0.9387730379182273,"{ FCu+AgBr-CuBr}"]
["( ICs)",119.178,120.29982269999999,1.1218227,0.9413001560690732,"{ I K+CsCl- KCl}"]
["(Mg S)",528.74,523.7425573,-4.9974427,-0.9451607028028898,"{Mg F+ S H- F H}"]
["(Br I)",269,266.4536378,-2.5463622,-0.9466030483271375,"{BrAg+ I I-Ag I}"]
["( H S)",2696.2475,2721.8689292,25.6214292,0.9502625111381653,"{ H O+ SSn- OSn}"]
["( IBi)",163.8,165.3585636,1.5585636,0.9515040293040292,"{ IAu+Bi H-Au H}"]
["(BrAg)",247.7,245.3422876,-2.3577124,-0.9518419055308843,"{BrCl+Ag I-Cl I}"]
["( OCl)",853.64268,861.7972538,8.1545738,0.9552678176775322,"{ O H+Cl N- H N}"]
["( FCa)",581.1,586.6581655,5.5581655,0.956490363104457,"{ FSi+Ca O-Si O}"]
["( PAs)",604.04,598.2612583,-5.7787417,-0.956681958148467,"{ P P+AsSb- PSb}"]
["(BrAg)",247.7,245.3239619,-2.3760381,-0.9592402503027857,"{BrPb+AgCl-PbCl}"]
["(CuBr)",314.8,311.7784854,-3.0215146,-0.9598203939008895,"{Cu I+BrTe- ITe}"]
["( FAu)",563.697,569.1334126,5.4364126,0.964421063088858,"{ F N+AuCl- NCl}"]
["(SiCl)",535.59,540.7631832,5.1731832,0.9658849493082395,"{Si O+ClSb- OSb}"]
["(Si S)",749.64559,756.9026265,7.2570365,0.9680623212897177,"{Si O+ SSe- OSe}"]
["(ClAg)",343.49,346.8152263,3.3252263,0.968070773530525,"{ClAs+Ag H-As H}"]
["(ClCl)",559.751,565.171518,5.420518,0.9683802262077246,"{ClAu+ClAu-AuAu}"]
["(AgAg)",192.4,194.2653665,1.8653665,0.9695252079002079,"{Ag O+AgCl- OCl}"]
["(LiBr)",563.1,568.564953,5.464953,0.9705119872136387,"{LiCl+BrCa-ClCa}"]
["(Br I)",269,271.6121062,2.6121062,0.9710431970260223,"{BrAg+ I F-Ag F}"]
["(ClAu)",383.6,387.3272647,3.7272647,0.9716539885297184,"{ClAg+AuBr-AgBr}"]
["(Li I)",498.16,503.0027306,4.8427306,0.9721235346073551,"{LiCl+ ICa-ClCa}"]
["(BrRb)",169.46,167.8089555,-1.6510445,-0.9742974743302255,"{BrNa+Rb I-Na I}"]
["( HAs)",2130,2109.228218,-20.771782,-0.9752010328638498,"{ HCu+AsCl-CuCl}"]
["(Li O)",814.64,806.6756201,-7.9643799,-0.9776563758224492,"{LiBr+ OTe-BrTe}"]
["( HCu)",1941.61045,1960.6444113,19.0339613,0.9803182353082206,"{ HCl+CuAg-ClAg}"]
["( FAs)",685.78,692.5138149,6.7338149,0.9819205721951645,"{ F P+As P- P P}"]
["(BiBi)",172.71,174.4162349,1.7062349,0.9879189971628742,"{Bi F+Bi F- F F}"]
["( HNa)",1171.968,1183.549211,11.581211,0.988184916311708,"{ HMg+Na I-Mg I}"]
["(Ca I)",238.7,236.335216,-2.364784,-0.9906929199832427,"{CaCl+ ILi-ClLi}"]
["( F I)",610,603.9469917,-6.0530083,-0.9922964426229508,"{ FAg+ IBr-AgBr}"]
["(CaBr)",285.3,282.4585515,-2.8414485,-0.9959511041009462,"{CaCl+BrLi-ClLi}"]
["(ClCu)",415.29,411.1462833,-4.1437167,-0.9977887018709817,"{ClAu+CuBr-AuBr}"]
["( OBi)",692.4,699.3088624,6.9088624,0.9978137492778741,"{ ONa+Bi I-Na I}"]
[]
["(BrTe)",267.4,270.0741562,2.6741562,1.0000584143605087,"{BrCu+Te I-Cu I}"]
["( SPb)",429,433.2931428,4.2931428,1.0007325874125874,"{ SSn+Pb O-Sn O}"]
["( F P)",846.75,855.2466413,8.4966413,1.0034415470918217,"{ F O+ P O- O O}"]
[]
[174,"AC{AA+BC-BB}","scheme","δ","δ%"]
["( H O)",3737.761,3742.0034454,4.2424454,0.11350231863406998,"{ H H+ N O- N N}"]
["(Pt H)",2294.68,2294.6940055,0.0140055,0.0006103465406941273,"{PtPt+ N H- N N}"]
["( N H)",3282.72,3282.6815565,-0.0384435,-0.00117108678169323,"{ N N+Pt H-PtPt}"]
["( ICu)",264.5,264.5221022,0.0221022,0.008356219281663515,"{ I I+BrCu-BrBr}"]
["(RbLi)",195.1839246,195.2019296,0.018005,0.009224632631451863,"{RbRb+ HLi- H H}"]
["(BrCu)",314.8,314.7689994,-0.0310006,-0.009847712833545108,"{BrBr+ ICu- I I}"]
["(SbBi)",220,219.9624778,-0.0375222,-0.017055545454545455,"{SbSb+ FBi- F F}"]
["(BrCl)",444,444.0873308,0.0873308,0.0196690990990991,"{BrBr+AuCl-AuAu}"]
["( FBi)",511,511.1069669,0.1069669,0.020932857142857142,"{ F F+SbBi-SbSb}"]
["(BiSb)",220,220.0475136,0.0475136,0.021597090909090913,"{BiBi+ PSb- P P}"]
["(Ag I)",206.52,206.5829612,0.0629612,0.030486732519852795,"{AgAg+Cl I-ClCl}"]
["( PSb)",500.07,499.8905096,-0.1794904,-0.03589305497230388,"{ P P+BiSb-BiBi}"]
["( O N)",1904.1346,1902.9747849,-1.1598151,-0.060910352660993615,"{ O O+ C N- C C}"]
["( C N)",2068.648,2069.9374991,1.2894991,0.062335356232669836,"{ C C+ O N- O O}"]
["( B O)",1885.286,1884.0911569,-1.1948431,-0.06337728599268226,"{ B B+Zr O-ZrZr}"]
["( HLi)",1405.49805,1404.5848047,-0.9132453,-0.06497663230482605,"{ H H+RbLi-RbRb}"]
["( V O)",1011,1010.2841022,-0.7158978,-0.07081086053412464,"{ V V+ W O- W W}"]
["(Zr O)",969.7,968.9790441,-0.7209559,-0.07434834484892233,"{ZrZr+ B O- B B}"]
["(ClCu)",415.29,415.6032882,0.3132882,0.0754384165282092,"{ClCl+ OCu- O O}"]
["( W O)",1059.9,1060.9334047,1.0334047,0.09750020756675157,"{ W W+ V O- V V}"]
["(Tb O)",824.3,825.2005363,0.9005363,0.10924861094261798,"{TbTb+ Y O- Y Y}"]
["( Y O)",861,860.045842,-0.954158,-0.11081974448315911,"{ Y Y+Tb O-TbTb}"]
["(SiCl)",535.59,536.2615476,0.6715476,0.12538464123676693,"{SiSi+BrCl-BrBr}"]
["(SbBi)",220,220.2891004,0.2891004,0.13140927272727274,"{SbSb+ SBi- S S}"]
["(AuBr)",264.4,264.0224426,-0.3775574,-0.14279780635400907,"{AuAu+ClBr-ClCl}"]
["(ClAg)",343.49,342.9752996,-0.5147004,-0.1498443622812891,"{ClCl+BrAg-BrBr}"]
["( SBi)",408.71,408.0418679,-0.6681321,-0.16347339189156126,"{ S S+SbBi-SbSb}"]
["(Bi F)",511,510.1600929,-0.8399071,-0.16436538160469666,"{BiBi+ S F- S S}"]
["( FBi)",511,511.9315941,0.9315941,0.18230804305283757,"{ F F+ SBi- S S}"]
["( SBi)",408.71,407.9552023,-0.7547977,-0.1846780602383108,"{ S S+ FBi- F F}"]
["( IAg)",206.52,206.9025333,0.3825333,0.18522821034282394,"{ I I+BrAg-BrBr}"]
["(Cu S)",415,415.7847166,0.7847166,0.1890883373493976,"{CuCu+ O S- O O}"]
["( I F)",610,611.1582951,1.1582951,0.18988444262295082,"{ I I+ B F- B B}"]
["(CuAu)",250,250.5061203,0.5061203,0.20244811999999998,"{CuCu+ IAu- I I}"]
["(Se S)",555.56,556.7422281,1.1822281,0.21279935560515514,"{SeSe+ F S- F F}"]
["( N O)",1904.1346,1899.7402163,-4.3943837,-0.23078114855956083,"{ N N+ H O- H H}"]
["(Br H)",2649,2655.2592157,6.2592157,0.2362859833899585,"{BrBr+Cl H-ClCl}"]
["(AgCl)",343.49,344.3190604,0.8290604,0.24136376604850215,"{AgAg+ FCl- F F}"]
["( IAu)",215.77,215.2469364,-0.5230636,-0.2424172035037308,"{ I I+CuAu-CuCu}"]
["(SbAs)",343,342.1593668,-0.8406332,-0.24508256559766764,"{SbSb+ PAs- P P}"]
["(ClAu)",383.6,384.5812416,0.9812416,0.2557981230448384,"{ClCl+ HAu- H H}"]
["(Cr O)",898.4,900.7573014,2.3573014,0.2623888468388246,"{CrCr+ C O- C C}"]
["(Cl H)",2990.9,2982.9581888,-7.9418112,-0.2655324885485974,"{ClCl+Br H-BrBr}"]
["(AgBr)",247.7,247.0087574,-0.6912426,-0.27906443278159065,"{AgAg+ IBr- I I}"]
["( HAg)",1759.7496,1754.72537,-5.02423,-0.2855082336714269,"{ H H+ OAg- O O}"]
["(AgAu)",198.22,197.6534657,-0.5665343,-0.28581086671375244,"{AgAg+ FAu- F F}"]
["(Cu S)",415,416.2509192,1.2509192,0.30142631325301206,"{CuCu+ C S- C C}"]
["( S F)",837.6418,840.1911866,2.5493866,0.3043528391252681,"{ S S+Bi F-BiBi}"]
["( IAg)",206.52,207.151248,0.631248,0.30565950029052874,"{ I I+ClAg-ClCl}"]
["( HAu)",2305.50082,2298.3688882,-7.1319318,-0.30934414501748037,"{ H H+ClAu-ClCl}"]
["(CsRb)",50.0137382,49.8586697,-0.1550685,-0.3100518089247726,"{CsCs+ KRb- K K}"]
["( SCu)",415,413.7117425,-1.2882575,-0.31042349397590363,"{ S S+ HCu- H H}"]
["( OAg)",490.2,491.7270132,1.5270132,0.3115082007343941,"{ O O+ HAg- H H}"]
["( IBr)",269,268.1573759,-0.8426241,-0.3132431598513011,"{ I I+AuBr-AuAu}"]
["(Pb H)",1564.1,1559.1525989,-4.9474011,-0.31630976919634296,"{PbPb+ I H- I I}"]
["( HCu)",1941.61045,1947.8419769,6.2315269,0.3209463000160511,"{ H H+ SCu- S S}"]
["(AuAg)",198.22,197.5711527,-0.6488473,-0.32733694884471803,"{AuAu+ClAg-ClCl}"]
["( ICu)",264.5,265.3818042,0.8818042,0.3333853308128545,"{ I I+ OCu- O O}"]
["(Lu H)",1520,1514.9218801,-5.0781199,-0.3340868355263158,"{LuLu+Au H-AuAu}"]
["(Si H)",2042.5229,2035.6637975,-6.8591025,-0.3358152067719779,"{SiSi+ B H- B B}"]
["(AgCl)",343.49,342.3146443,-1.1753557,-0.342180471047192,"{AgAg+ ICl- I I}"]
["(Au F)",563.697,565.6299949,1.9329949,0.3429138171748297,"{AuAu+Cl F-ClCl}"]
["(ClCu)",415.29,413.8416349,-1.4483651,-0.348759926798141,"{ClCl+BrCu-BrBr}"]
["(AgCu)",231.8,232.6107286,0.8107286,0.349753494391717,"{AgAg+ HCu- H H}"]
["(Bi S)",408.71,407.2747364,-1.4352636,-0.35116919086883125,"{BiBi+ F S- F F}"]
["(As O)",967.08,963.6303181,-3.4496819,-0.35671112007279643,"{AsAs+ P O- P P}"]
["(Ni H)",1926.6,1933.5196858,6.9196858,0.35916567009239075,"{NiNi+ I H- I I}"]
["(ClCu)",415.29,413.7964143,-1.4935857,-0.35964884779310835,"{ClCl+ ICu- I I}"]
["( PAs)",604.04,606.2349937,2.1949937,0.3633854877160453,"{ P P+SbAs-SbSb}"]
["( KRb)",75.8418,76.1234082,0.2816082,0.37131001637619354,"{ K K+CsRb-CsCs}"]
["(ClAg)",343.49,344.7875125,1.2975125,0.37774389356313137,"{ClCl+AuAg-AuAu}"]
["(ClAg)",343.49,342.1845772,-1.3054228,-0.3800468135899153,"{ClCl+ IAg- I I}"]
["(BiSb)",220,219.1568841,-0.8431159,-0.3832345,"{BiBi+AsSb-AsAs}"]
["(BrCu)",314.8,316.0069741,1.2069741,0.3834098157560356,"{BrBr+ OCu- O O}"]
["(CsLi)",184.69891,183.968106,-0.730804,-0.3956731525919671,"{CsCs+ FLi- F F}"]
["(Cs K)",68.394,68.6678366,0.2738366,0.40038102757551824,"{CsCs+Na K-NaNa}"]
["( B F)",1402.15865,1396.278851,-5.879799,-0.41933906694509926,"{ B B+ I F- I I}"]
["(Sb P)",500.07,497.9663736,-2.1036264,-0.4206663867058612,"{SbSb+ C P- C C}"]
["( B H)",2366.7296,2376.9753209,10.2457209,0.43290627285854705,"{ B B+Si H-SiSi}"]
["( O S)",1150.7913,1155.7859881,4.9946881,0.4340220594298897,"{ O O+ C S- C C}"]
["( C S)",1285.15464,1279.5354453,-5.6191947,-0.4372387979706474,"{ C C+ O S- O O}"]
["( IBr)",269,267.8171287,-1.1828713,-0.43972910780669144,"{ I I+ClBr-ClCl}"]
["(BrAu)",264.4,263.2357667,-1.1642333,-0.4403302950075644,"{BrBr+ HAu- H H}"]
["( FAs)",685.78,682.7176271,-3.0623729,-0.4465532532298988,"{ F F+ SAs- S S}"]
["(AuAg)",198.22,197.3135031,-0.9064969,-0.45731858541015036,"{AuAu+BrAg-BrBr}"]
["( SAs)",567.94,570.5471758,2.6071758,0.45905831601929775,"{ S S+ FAs- F F}"]
["(Cl F)",783.4534,779.8108167,-3.6425833,-0.464939369718735,"{ClCl+Au F-AuAu}"]
["(AuCl)",383.6,385.3968848,1.7968848,0.4684266944734098,"{AuAu+SiCl-SiSi}"]
["(Si H)",2042.5229,2052.1225037,9.5996037,0.46998756782604495,"{SiSi+ C H- C C}"]
["( P O)",1233.34,1239.1375615,5.7975615,0.4700700131350642,"{ P P+As O-AsAs}"]
["(SiCl)",535.59,533.0661506,-2.5238494,-0.4712278795347187,"{SiSi+AuCl-AuAu}"]
["(Au I)",215.77,216.7957247,1.0257247,0.4753787366176948,"{AuAu+ H I- H H}"]
["(Cu S)",415,413.0212226,-1.9787774,-0.4768138313253012,"{CuCu+Te S-TeTe}"]
["(SeTe)",316,317.5310743,1.5310743,0.48451718354430384,"{SeSe+ STe- S S}"]
["(BrAg)",247.7,246.4914739,-1.2085261,-0.4878991118288252,"{BrBr+CuAg-CuCu}"]
["(Cl I)",384,385.8768217,1.8768217,0.4887556510416667,"{ClCl+Ag I-AgAg}"]
["( I H)",2309,2297.1354839,-11.8645161,-0.5138378562148116,"{ I I+Ni H-NiNi}"]
["(BrCl)",444,446.3637418,2.3637418,0.5323742792792794,"{BrBr+SiCl-SiSi}"]
["(AgCu)",231.8,233.0377459,1.2377459,0.5339714840379637,"{AgAg+ SCu- S S}"]
["(Pb H)",1564.1,1555.4730148,-8.6269852,-0.5515622530528739,"{PbPb+Ni H-NiNi}"]
["(Au H)",2305.50082,2292.447329,-13.053491,-0.5661889549880966,"{AuAu+ O H- O O}"]
["( OCu)",640.17,636.5251397,-3.6448603,-0.5693581861068154,"{ O O+BrCu-BrBr}"]
["(AsSb)",343,344.957509,1.957509,0.570702332361516,"{AsAs+BiSb-BiBi}"]
["(Lu H)",1520,1511.2028954,-8.7971046,-0.5787568815789474,"{LuLu+ O H- O O}"]
["( FCl)",783.4534,778.9137766,-4.5396234,-0.5794375772700713,"{ F F+AgCl-AgAg}"]
["( OCu)",640.17,636.4317883,-3.7382117,-0.5839404689379384,"{ O O+ ICu- I I}"]
["( FAu)",563.697,566.9977741,3.3007741,0.5855582165596056,"{ F F+AgAu-AgAg}"]
["(Lu H)",1520,1528.9651318,8.9651318,0.589811302631579,"{LuLu+Cu H-CuCu}"]
["(AuCl)",383.6,385.8749411,2.2749411,0.593050338894682,"{AuAu+BrCl-BrBr}"]
["(AsSb)",343,345.0681524,2.0681524,0.6029598833819242,"{AsAs+ PSb- P P}"]
["( HAu)",2305.50082,2319.4543864,13.9535664,0.6052292967737916,"{ H H+BrAu-BrBr}"]
["( HCu)",1941.61045,1929.8494209,-11.7610291,-0.6057357746503682,"{ H H+AgCu-AgAg}"]
["( IAg)",206.52,207.7772549,1.2572549,0.6087811834204919,"{ I I+AuAg-AuAu}"]
["( V O)",1011,1017.266,6.266,0.6197823936696341,"{ V V+ S O- S S}"]
["(Na K)",124.0228834,123.2512732,-0.7716102,-0.6221514762815133,"{NaNa+Cs K-CsCs}"]
["( SSe)",555.56,559.0619723,3.5019723,0.6303499712002304,"{ S S+TeSe-TeTe}"]
["(Si F)",837.32507,831.9662097,-5.3588603,-0.6399975937660627,"{SiSi+ B F- B B}"]
["( F S)",837.6418,843.0314022,5.3896022,0.6434256504391256,"{ F F+Bi S-BiBi}"]
["( OCu)",640.17,644.3031569,4.1331569,0.645634269022291,"{ O O+ClCu-ClCl}"]
["(AuAg)",198.22,196.9173855,-1.3026145,-0.6571559378468369,"{AuAu+ IAg- I I}"]
["(RbCs)",50.0137382,50.3432113,0.3294731,0.6587651950399501,"{RbRb+ KCs- K K}"]
["(BrAu)",264.4,262.638509,-1.761491,-0.6662220121028745,"{BrBr+ClAu-ClCl}"]
["( PSb)",500.07,496.7183707,-3.3516293,-0.6702320275161477,"{ P P+AsSb-AsAs}"]
["( F S)",837.6418,831.949643,-5.692157,-0.6795454811352537,"{ F F+Se S-SeSe}"]
["(SePb)",278,279.9148108,1.9148108,0.6887808633093525,"{SeSe+ SPb- S S}"]
["( S O)",1150.7913,1142.8625118,-7.9287882,-0.688985761362638,"{ S S+ V O- V V}"]
["( H I)",2309,2292.9985321,-16.0014679,-0.6930042399307059,"{ H H+Au I-AuAu}"]
["( I F)",610,614.2543565,4.2543565,0.6974354918032787,"{ I I+Si F-SiSi}"]
["(As P)",604.04,608.2539301,4.2139301,0.6976243460697967,"{AsAs+ C P- C C}"]
["( I H)",2309,2325.1106448,16.1106448,0.6977325595495886,"{ I I+Pb H-PbPb}"]
["( ICu)",264.5,266.3490155,1.8490155,0.6990606805293006,"{ I I+ClCu-ClCl}"]
["( P C)",1239.79924,1231.0991298,-8.7001102,-0.7017354035480775,"{ P P+ N C- N N}"]
["( KCs)",68.394,67.9139056,-0.4800944,-0.7019539725706933,"{ K K+RbCs-RbRb}"]
["(BiBr)",209.5,208.0204309,-1.4795691,-0.7062382338902148,"{BiBi+SbBr-SbSb}"]
["( FAl)",802.32447,796.5686905,-5.7557795,-0.7173880038832668,"{ F F+ OAl- O O}"]
["( O S)",1150.7913,1142.4915732,-8.2997268,-0.7212191124489731,"{ O O+Cu S-CuCu}"]
["(Bi S)",408.71,405.7452943,-2.9647057,-0.7253812483178783,"{BiBi+Se S-SeSe}"]
["(Cr O)",898.4,891.8733883,-6.5266117,-0.7264705810329475,"{CrCr+As O-AsAs}"]
["(ClAu)",383.6,386.4963619,2.8963619,0.7550474191866527,"{ClCl+BrAu-BrBr}"]
["(Se O)",914.69,907.7828522,-6.9071478,-0.7551353791995101,"{SeSe+ C O- C C}"]
["(Te S)",471.18,474.7502954,3.5702954,0.7577349208370474,"{TeTe+Cu S-CuCu}"]
["(Se S)",555.56,559.7702021,4.2102021,0.7578303153574772,"{SeSe+Bi S-BiBi}"]
["( S O)",1150.7913,1141.9495232,-8.8417768,-0.7683214845298186,"{ S S+ W O- W W}"]
["(Pb F)",503,499.1106119,-3.8893881,-0.7732381908548708,"{PbPb+Al F-AlAl}"]
["(Au H)",2305.50082,2323.5285872,18.0277672,0.7819458160071266,"{AuAu+Lu H-LuLu}"]
["(AuBr)",264.4,266.4799549,2.0799549,0.786669780635401,"{AuAu+ IBr- I I}"]
["(SbBr)",242.7,244.6614755,1.9614755,0.8081893283889576,"{SbSb+BiBr-BiBi}"]
["(BrCu)",314.8,317.3674108,2.5674108,0.8155688691232529,"{BrBr+ClCu-ClCl}"]
["(Ni H)",1926.6,1910.8446435,-15.7553565,-0.8177803643724696,"{NiNi+Cl H-ClCl}"]
["(AgBr)",247.7,245.6691004,-2.0308996,-0.8199029471134437,"{AgAg+AuBr-AuAu}"]
["( ITe)",217,215.2001892,-1.7998108,-0.8294058986175116,"{ I I+BrTe-BrBr}"]
["(Ni H)",1926.6,1942.8638349,16.2638349,0.8441728900654002,"{NiNi+Pb H-PbPb}"]
["(ClBr)",444,447.7581242,3.7581242,0.8464243693693694,"{ClCl+AuBr-AuAu}"]
["( SPb)",429,425.3420419,-3.6579581,-0.8526708857808858,"{ S S+SePb-SeSe}"]
["(Cu O)",640.17,645.6946173,5.5246173,0.8629922208163456,"{CuCu+Zr O-ZrZr}"]
["( C H)",2860.7508,2836.043151,-24.707649,-0.8636770808558369,"{ C C+Si H-SiSi}"]
["(Cu O)",640.17,645.7886052,5.6186052,0.8776739303622476,"{CuCu+ B O- B B}"]
["(Si F)",837.32507,829.9669773,-7.3580927,-0.8787617812518143,"{SiSi+ I F- I I}"]
["( C O)",2169.75589,2150.5798472,-19.1760428,-0.8837880283389853,"{ C C+Cr O-CrCr}"]
["( SCu)",415,411.2793311,-3.7206689,-0.8965467228915663,"{ S S+AgCu-AgAg}"]
["(As F)",685.78,691.9312896,6.1512896,0.8969771063606404,"{AsAs+ P F- P P}"]
["(BrAg)",247.7,249.9401177,2.2401177,0.9043672587807833,"{BrBr+ IAg- I I}"]
["(As O)",967.08,975.9164025,8.8364025,0.9137199094180419,"{AsAs+Cr O-CrCr}"]
["(AgBr)",247.7,245.4248864,-2.2751136,-0.918495599515543,"{AgAg+ClBr-ClCl}"]
["(Ag F)",513.447,508.7207563,-4.7262437,-0.9204930012250534,"{AgAg+Si F-SiSi}"]
["( W O)",1059.9,1069.7052121,9.8052121,0.9251072837060099,"{ W W+ S O- S S}"]
["( C P)",1239.79924,1251.2729861,11.4737461,0.9254519384928805,"{ C C+Sb P-SbSb}"]
["(Cu H)",1941.61045,1923.5299756,-18.0804744,-0.9312101920341437,"{CuCu+Lu H-LuLu}"]
["(Ni H)",1926.6,1908.5946696,-18.0053304,-0.9345650576144502,"{NiNi+Br H-BrBr}"]
["(Sb P)",500.07,495.3580771,-4.7119229,-0.9422526646269522,"{SbSb+As P-AsAs}"]
["(Cr O)",898.4,906.9438951,8.5438951,0.9510123664292075,"{CrCr+Se O-SeSe}"]
["(Bi F)",511,515.9692812,4.9692812,0.9724620743639922,"{BiBi+ C F- C C}"]
["( OAl)",979.4852,989.1622289,9.6770289,0.9879709157422695,"{ O O+ FAl- F F}"]
["(BrTe)",267.4,270.0467054,2.6467054,0.9897925953627527,"{BrBr+ ITe- I I}"]