
 **** DERIVATIVE DATABASE ****    
+DDB, Version number    100401

  Note : temporary (transfer) database

    usepaw         0
     natom         2
      nkpt         1
    nsppol         1
      nsym         1
    ntypat         2
    occopt         1
     nband         8
     acell  0.77030079150000D+01  0.77030079150000D+01  0.77030079150000D+01
       amu  0.69410000000000D+01  0.18998403200000D+02
   dilatmx  0.10000000000000D+01
      ecut  0.50000000000000D+01
    ecutsm  0.00000000000000D+00
     intxc         0
      iscf        -2
       ixc         1
       kpt  0.00000000000000D+00  0.00000000000000D+00  0.00000000000000D+00
    kptnrm  0.10000000000000D+01
     ngfft        12   12   12
    nspden         1
   nspinor         1
       occ  0.20000000000000D+01  0.20000000000000D+01  0.20000000000000D+01
            0.20000000000000D+01  0.00000000000000D+00  0.00000000000000D+00
            0.00000000000000D+00  0.00000000000000D+00
     rprim  0.00000000000000D+00  0.50000000000000D+00  0.50000000000000D+00
            0.50000000000000D+00  0.00000000000000D+00  0.50000000000000D+00
            0.50000000000000D+00  0.50000000000000D+00  0.00000000000000D+00
  dfpt_sciss  0.00000000000000D+00
    spinat  0.00000000000000D+00  0.00000000000000D+00  0.00000000000000D+00
            0.00000000000000D+00  0.00000000000000D+00  0.00000000000000D+00
    symafm         1
    symrel         1    0    0    0    1    0    0    0    1
     tnons  0.00000000000000D+00  0.00000000000000D+00  0.00000000000000D+00
    tolwfr  0.10000000000000D+01
   tphysel  0.00000000000000D+00
    tsmear  0.10000000000000D-01
     typat         1    2
       wtk  0.10000000000000D+01
      xred  0.00000000000000D+00  0.00000000000000D+00  0.00000000000000D+00
            0.50000000000000D+00  0.50000000000000D+00  0.50000000000000D+00
     znucl  0.30000000000000D+01  0.90000000000000D+01
      zion  0.10000000000000D+01  0.70000000000000D+01
 
  Description of the potentials (KB energies)
  vrsio8 (for pseudopotentials)=100401
  usepaw =  0
  dimekb =  1       lmnmax=  1
  Atom type=    1   pspso=  0   nekb=   1
  iln lpsang iproj  ekb(:)
     1     0     1     1.2427973E+00
  Atom type=    2   pspso=  0   nekb=   1
  iln lpsang iproj  ekb(:)
     1     0     1     6.3102278E+00
 
 **** Database of total energy derivatives ****
 Number of data blocks=    1

 2nd eigenvalue derivatives   - # elements :      36
 qpt  0.00000000E+00  0.00000000E+00  0.00000000E+00 1.0
 K-point:  0.00000000E+00  0.00000000E+00  0.00000000E+00
 Band:    1
   1   1   1   1 -0.78558644749035D-03 -0.52346349939055D-20
   2   1   1   1 -0.39279318094970D-03  0.13670033424771D-11
   3   1   1   1 -0.39279327658787D-03 -0.69088286432517D-12
   1   2   1   1  0.44898275240055D-01 -0.39018488960448D-08
   2   2   1   1  0.22449132526971D-01  0.68950900002420D-09
   3   2   1   1  0.22449137605209D-01 -0.46825035018856D-08
   1   1   2   1 -0.39279318094970D-03 -0.13670033513326D-11
   2   1   2   1 -0.78558631953407D-03 -0.33054886506152D-20
   3   1   2   1 -0.39279314567782D-03 -0.24015299348289D-11
   1   2   2   1  0.22449136587045D-01  0.93913308968944D-09
   2   2   2   1  0.44898270105875D-01  0.28715707979446D-08
   3   2   2   1  0.22449134834524D-01  0.29795965666889D-08
   1   1   3   1 -0.39279327658787D-03  0.69088285707225D-12
   2   1   3   1 -0.39279314567782D-03  0.24015299278223D-11
   3   1   3   1 -0.78558630889419D-03 -0.28767784682494D-20
   1   2   3   1  0.22449146185472D-01 -0.50188128514503D-08
   2   2   3   1  0.22449135883942D-01  0.22920226323971D-08
   3   2   3   1  0.44898270115873D-01 -0.30746256775859D-08
   1   1   1   2  0.44898275240055D-01  0.39018488970144D-08
   2   1   1   2  0.22449136587045D-01 -0.93913308880626D-09
   3   1   1   2  0.22449146185472D-01  0.50188128519501D-08
   1   2   1   2 -0.61839301759057D+01 -0.52304661687312D-16
   2   2   1   2 -0.30919650847903D+01  0.34774270372021D-08
   3   2   1   2 -0.30919651047513D+01 -0.36939842656540D-07
   1   1   2   2  0.22449132526971D-01 -0.68950899926272D-09
   2   1   2   2  0.44898270105875D-01 -0.28715707972368D-08
   3   1   2   2  0.22449135883942D-01 -0.22920226321637D-08
   1   2   2   2 -0.30919650847903D+01 -0.34774271037463D-08
   2   2   2   2 -0.61839301655654D+01 -0.30140290999505D-16
   3   2   2   2 -0.30919650462313D+01 -0.47800468228416D-07
   1   1   3   2  0.22449137605209D-01  0.46825035026663D-08
   2   1   3   2  0.22449134834524D-01 -0.29795965659611D-08
   3   1   3   2  0.44898270115872D-01  0.30746256783452D-08
   1   2   3   2 -0.30919651047513D+01  0.36939842613108D-07
   2   2   3   2 -0.30919650462313D+01  0.47800468198972D-07
   3   2   3   2 -0.61839301813914D+01 -0.50209907849722D-16
 Band:    2
   1   1   1   1 -0.10966153678881D+00  0.11146527587851D-18
   2   1   1   1 -0.57759291915164D-01  0.10481566817797D-05
   3   1   1   1 -0.14620151282536D+00  0.31178464029610D-06
   1   2   1   1  0.49533237921803D+00 -0.24088557333654D-07
   2   2   1   1  0.19285490514830D+00  0.21880963407736D-05
   3   2   1   1  0.31675517054795D+00  0.64322440940970D-06
   1   1   2   1 -0.57759291915164D-01 -0.10481566817796D-05
   2   1   2   1 -0.13347875133065D+00 -0.65502943782972D-18
   3   1   2   1 -0.17907736603741D+00 -0.36087251541543D-05
   1   2   2   1  0.19285492107479D+00 -0.22074180325909D-05
   2   2   2   1  0.54001718301205D+00  0.66863473668364D-08
   3   2   2   1  0.36281153791115D+00 -0.75828094781351D-05
   1   1   3   1 -0.14620151282536D+00 -0.31178464029622D-06
   2   1   3   1 -0.17907736603741D+00  0.36087251541525D-05
   3   1   3   1 -0.46347980742064D+00 -0.17909105462651D-17
   1   2   3   1  0.31675521786583D+00 -0.66696573415902D-06
   2   2   3   1  0.36281154869171D+00  0.75703614074422D-05
   3   2   3   1  0.70049151244407D+00 -0.59064148971151D-08
   1   1   1   2  0.49533237921803D+00  0.24088557329153D-07
   2   1   1   2  0.19285492107479D+00  0.22074180325894D-05
   3   1   1   2  0.31675521786583D+00  0.66696573414152D-06
   1   2   1   2 -0.18007435420247D+02  0.24422860957186D-15
   2   2   1   2 -0.79174132540625D+01 -0.90265269061333D-04
   3   2   1   2 -0.11041771632833D+02 -0.26645108962281D-04
   1   1   2   2  0.19285490514830D+00 -0.21880963407706D-05
   2   1   2   2  0.54001718301205D+00 -0.66863473738906D-08
   3   1   2   2  0.36281154869171D+00 -0.75703614074600D-05
   1   2   2   2 -0.79174132540625D+01  0.90265269061527D-04
   2   2   2   2 -0.19077398241620D+02  0.23981035337008D-15
   3   2   2   2 -0.12203162161248D+02  0.31157403109048D-03
   1   1   3   2  0.31675517054795D+00 -0.64322440939210D-06
   2   1   3   2  0.36281153791115D+00  0.75828094781403D-05
   3   1   3   2  0.70049151244408D+00  0.59064149479581D-08
   1   2   3   2 -0.11041771632833D+02  0.26645108962369D-04
   2   2   3   2 -0.12203162161248D+02 -0.31157403109029D-03
   3   2   3   2 -0.24639776421044D+02 -0.40009124807524D-15
 Band:    3
   1   1   1   1 -0.10376690722968D+00 -0.56279859273490D-18
   2   1   1   1 -0.10164783055716D+00 -0.36848295267537D-05
   3   1   1   1 -0.46054633032923D-01  0.11365297577079D-06
   1   2   1   1  0.53553242878535D+00  0.13747643774796D-07
   2   2   1   1  0.31003305040318D+00 -0.77298603329021D-05
   3   2   1   1  0.23215157009784D+00  0.25633444529015D-06
   1   1   2   1 -0.10164783055716D+00  0.36848295267535D-05
   2   1   2   1 -0.40995685387027D+00 -0.13705243308710D-17
   3   1   2   1 -0.10161773789889D+00  0.44457711575970D-05
   1   2   2   1  0.31003307452882D+00  0.77334208385755D-05
   2   2   2   1  0.65131882134158D+00 -0.26915592221012D-08
   3   2   2   1  0.30999091846584D+00  0.93307282633983D-05
   1   1   3   1 -0.46054633032923D-01 -0.11365297577102D-06
   2   1   3   1 -0.10161773789889D+00 -0.44457711575970D-05
   3   1   3   1 -0.10375101323841D+00 -0.47453862817065D-18
   1   2   3   1  0.23215161533980D+00 -0.21944498436279D-06
   2   2   3   1  0.30999091502901D+00 -0.93229506540246D-05
   3   2   3   1  0.53549241385634D+00  0.23993822438328D-07
   1   1   1   2  0.53553242878535D+00 -0.13747643781297D-07
   2   1   1   2  0.31003307452882D+00 -0.77334208385950D-05
   3   1   1   2  0.23215161533980D+00  0.21944498436484D-06
   1   2   1   2 -0.18777801096804D+02  0.13070353650844D-15
   2   2   1   2 -0.10592576395402D+02  0.31779013332325D-03
   3   2   1   2 -0.86286601720129D+01 -0.97662422769894D-05
   1   1   2   2  0.31003305040318D+00  0.77298603329194D-05
   2   1   2   2  0.65131882134158D+00  0.26915592527948D-08
   3   1   2   2  0.30999091502901D+00  0.93229506540315D-05
   1   2   2   2 -0.10592576395402D+02 -0.31779013332322D-03
   2   2   2   2 -0.23270196031826D+02 -0.36468347093500D-15
   3   2   2   2 -0.10591513094944D+02 -0.38329964957238D-03
   1   1   3   2  0.23215157009784D+00 -0.25633444528401D-06
   2   1   3   2  0.30999091846584D+00 -0.93307282633993D-05
   3   1   3   2  0.53549241385634D+00 -0.23993822426661D-07
   1   2   3   2 -0.86286601720129D+01  0.97662422770208D-05
   2   2   3   2 -0.10591513094944D+02  0.38329964957252D-03
   3   2   3   2 -0.18776881218022D+02  0.15766253057674D-15
 Band:    4
   1   1   1   1 -0.46346349465277D+00 -0.60973728746647D-17
   2   1   1   1 -0.17903884002519D+00  0.26353131950766D-05
   3   1   1   1 -0.14618983454143D+00 -0.41859484859612D-06
   1   2   1   1  0.70047515817746D+00 -0.13890011919815D-07
   2   2   1   1  0.36278196655393D+00  0.55160636030292D-05
   3   2   1   1  0.31676323727622D+00 -0.91023464619962D-06
   1   1   2   1 -0.17903884002519D+00 -0.26353131950806D-05
   2   1   2   1 -0.13345634691885D+00 -0.11744211075354D-17
   3   1   2   1 -0.57750873243149D-01 -0.82807864227687D-06
   1   2   2   1  0.36278197727415D+00 -0.55304766711231D-05
   2   2   2   1  0.54000393786691D+00 -0.47796082089573D-09
   3   2   2   1  0.19286751218043D+00 -0.17496512797534D-05
   1   1   3   1 -0.14618983454143D+00  0.41859484859317D-06
   2   1   3   1 -0.57750873243149D-01  0.82807864227639D-06
   3   1   3   1 -0.10966114110399D+00 -0.12971374873107D-17
   1   2   3   1  0.31676327340685D+00  0.86643485435912D-06
   2   2   3   1  0.19286754390478D+00  0.17253829938107D-05
   3   2   3   1  0.49535602006738D+00 -0.26116543673107D-07
   1   1   1   2  0.70047515817746D+00  0.13890011970171D-07
   2   1   1   2  0.36278197727415D+00  0.55304766711475D-05
   3   1   1   2  0.31676327340685D+00 -0.86643485434314D-06
   1   2   1   2 -0.24639331971635D+02 -0.50007978172947D-15
   2   2   1   2 -0.12202294565766D+02 -0.22700535917917D-03
   3   2   1   2 -0.11041852354607D+02  0.36447038491514D-04
   1   1   2   2  0.36278196655393D+00 -0.55160636030104D-05
   2   1   2   2  0.54000393786691D+00  0.47796082685776D-09
   3   1   2   2  0.19286754390478D+00 -0.17253829938056D-05
   1   2   2   2 -0.12202294565766D+02  0.22700535917890D-03
   2   2   2   2 -0.19076973518997D+02  0.42004999129051D-16
   3   2   2   2 -0.79176084889183D+01  0.71380831211594D-04
   1   1   3   2  0.31676323727622D+00  0.91023464618352D-06
   2   1   3   2  0.19286751218043D+00  0.17496512797529D-05
   3   1   3   2  0.49535602006738D+00  0.26116543672443D-07
   1   2   3   2 -0.11041852354607D+02 -0.36447038491298D-04
   2   2   3   2 -0.79176084889183D+01 -0.71380831211577D-04
   3   2   3   2 -0.18007910292810D+02  0.20891225905036D-15
 Band:    5
   1   1   1   1 -0.53504859867579D+00 -0.10070148269214D-16
   2   1   1   1 -0.26752429952156D+00  0.22363180356181D-10
   3   1   1   1 -0.26752429648899D+00  0.59412439873319D-09
   1   2   1   1 -0.19722859429188D+00  0.11185508189647D-07
   2   2   1   1 -0.98614295658425D-01  0.37628844909178D-08
   3   2   1   1 -0.98614293394789D-01  0.10185687123144D-07
   1   1   2   1 -0.26752429952156D+00 -0.22363192419676D-10
   2   1   2   1 -0.53504858964524D+00 -0.99778329482988D-17
   3   1   2   1 -0.26752429206624D+00  0.69960959679663D-09
   1   2   2   1 -0.98614301636071D-01  0.37918303518929D-08
   2   2   2   1 -0.19722858936685D+00  0.39198048029748D-08
   3   2   2   1 -0.98614291264948D-01  0.36313982581118D-08
   1   1   3   1 -0.26752429648899D+00 -0.59412441270995D-09
   2   1   3   1 -0.26752429206624D+00 -0.69960960998633D-09
   3   1   3   1 -0.53504859149082D+00 -0.23623296017537D-16
   1   2   3   1 -0.98614296264546D-01  0.99547572222189D-08
   2   2   3   1 -0.98614290022495D-01  0.33266369543463D-08
   3   2   3   1 -0.19722858663897D+00  0.92998112105147D-08
   1   1   1   2 -0.19722859429188D+00 -0.11185508203239D-07
   2   1   1   2 -0.98614301636071D-01 -0.37918303646030D-08
   3   1   1   2 -0.98614296264546D-01 -0.99547572361761D-08
   1   2   1   2 -0.55097280532619D+00 -0.11519087047408D-16
   2   2   1   2 -0.27548640134523D+00  0.55412572484476D-13
   3   2   1   2 -0.27548639878353D+00 -0.43934049405472D-12
   1   1   2   2 -0.98614295658425D-01 -0.37628844988131D-08
   2   1   2   2 -0.19722858936685D+00 -0.39198048183619D-08
   3   1   2   2 -0.98614290022495D-01 -0.33266369594187D-08
   1   2   2   2 -0.27548640134523D+00 -0.55429490867654D-13
   2   2   2   2 -0.55097279216314D+00 -0.97801242707919D-17
   3   2   2   2 -0.27548638622853D+00 -0.57886222780284D-12
   1   1   3   2 -0.98614293394789D-01 -0.10185687125360D-07
   2   1   3   2 -0.98614291264948D-01 -0.36313982659323D-08
   3   1   3   2 -0.19722858663897D+00 -0.92998112265099D-08
   1   2   3   2 -0.27548639878353D+00  0.43932718375872D-12
   2   2   3   2 -0.27548638622853D+00  0.57885774120580D-12
   3   2   3   2 -0.55097278219745D+00 -0.13047492033075D-17
 Band:    6
   1   1   1   1 -0.15269382282915D+01 -0.15416211398265D-15
   2   1   1   1 -0.13470793260239D+01  0.62758361298077D-04
   3   1   1   1 -0.71313742040225D+00  0.31516424726887D-03
   1   2   1   1  0.18626978064336D+01  0.11166956820937D-06
   2   2   1   1  0.16650318106561D+01 -0.87390861204893D-04
   3   2   1   1  0.79015980260798D+00 -0.43887574877042D-03
   1   1   2   1 -0.13470793260239D+01 -0.62758361298489D-04
   2   1   2   1 -0.27883017569982D+01 -0.36109014541451D-15
   3   1   2   1 -0.13852372098782D+01 -0.39949888928588D-03
   1   2   2   1  0.16650318816641D+01  0.87422723870222D-04
   2   2   2   1  0.34449252953600D+01  0.44762194692618D-07
   3   2   2   1  0.17176915469181D+01  0.55628776155713D-03
   1   1   3   1 -0.71313742040225D+00 -0.31516424726916D-03
   2   1   3   1 -0.13852372098782D+01  0.39949888928560D-03
   3   1   3   1 -0.53917169427631D+01 -0.73716737416038D-15
   1   2   3   1  0.79015998813740D+00  0.43891384402653D-03
   2   2   3   1  0.17176916348679D+01 -0.55626423912359D-03
   3   2   3   1  0.61668877189786D+01 -0.76808047912093D-07
   1   1   1   2  0.18626978064336D+01 -0.11166956783982D-06
   2   1   1   2  0.16650318816641D+01 -0.87422723869832D-04
   3   1   1   2  0.79015998813740D+00 -0.43891384402565D-03
   1   2   1   2 -0.34485854635315D+01 -0.21285937964501D-15
   2   2   1   2 -0.27269428765529D+01  0.78497363417843D-04
   3   2   1   2 -0.17306586542378D+01  0.39416921407674D-03
   1   1   2   2  0.16650318106561D+01  0.87390861205309D-04
   2   1   2   2  0.34449252953600D+01 -0.44762193752543D-07
   3   1   2   2  0.17176916348679D+01  0.55626423912440D-03
   1   2   2   2 -0.27269428765529D+01 -0.78497363418189D-04
   2   2   2   2 -0.56197829565035D+01 -0.58835924955820D-15
   3   2   2   2 -0.27869105369235D+01 -0.49941037126674D-03
   1   1   3   2  0.79015980260798D+00  0.43887574877055D-03
   2   1   3   2  0.17176915469181D+01 -0.55628776155674D-03
   3   1   3   2  0.61668877189786D+01  0.76808052026432D-07
   1   2   3   2 -0.17306586542378D+01 -0.39416921407740D-03
   2   2   3   2 -0.27869105369235D+01  0.49941037126563D-03
   3   2   3   2 -0.10748900837201D+02 -0.39114084150402D-14
 Band:    7
   1   1   1   1 -0.41952310032803D+01 -0.95482636012188D-16
   2   1   1   1 -0.28262244328220D+01  0.52683826655202D-03
   3   1   1   1 -0.41294215961507D+01  0.41822140755888D-03
   1   2   1   1  0.50080992650762D+01  0.26486647598838D-06
   2   2   1   1  0.31382767717914D+01 -0.73364116457593D-03
   3   2   1   1  0.49367546129250D+01 -0.58222653587403D-03
   1   1   2   1 -0.28262244328220D+01 -0.52683826655251D-03
   2   1   2   1 -0.55412497423988D+01  0.67493279303117D-16
   3   1   2   1 -0.28246967327854D+01  0.29298668400930D-03
   1   2   2   1  0.31382767809555D+01  0.73419079346198D-03
   2   2   2   1  0.61525961053851D+01  0.44617229621175D-07
   3   2   2   1  0.31361683550459D+01 -0.40753401732766D-03
   1   1   3   1 -0.41294215961507D+01 -0.41822140755960D-03
   2   1   3   1 -0.28246967327854D+01 -0.29298668401018D-03
   3   1   3   1 -0.41937354924802D+01 -0.62830532335072D-15
   1   2   3   1  0.49367548005317D+01  0.58270577444946D-03
   2   2   3   1  0.31361684770686D+01  0.40809693413397D-03
   3   2   3   1  0.50060265703807D+01  0.21344963457005D-06
   1   1   1   2  0.50080992650762D+01 -0.26486647474972D-06
   2   1   1   2  0.31382767809555D+01 -0.73419079346091D-03
   3   1   1   2  0.49367548005317D+01 -0.58270577444765D-03
   1   2   1   2 -0.82818102332282D+01 -0.13001583045857D-14
   2   2   1   2 -0.57283617829486D+01  0.65925490916906D-03
   3   2   1   2 -0.77764273481485D+01  0.52308997150809D-03
   1   1   2   2  0.31382767717914D+01  0.73364116457703D-03
   2   1   2   2  0.61525961053851D+01 -0.44617227418981D-07
   3   1   2   2  0.31361684770686D+01 -0.40809693413262D-03
   1   2   2   2 -0.57283617829486D+01 -0.65925490917085D-03
   2   2   2   2 -0.11246814132084D+02 -0.30158845256215D-14
   3   2   2   2 -0.57259607035419D+01  0.36604109294980D-03
   1   1   3   2  0.49367546129250D+01  0.58222653587501D-03
   2   1   3   2  0.31361683550459D+01  0.40753401732930D-03
   3   1   3   2  0.50060265703807D+01 -0.21344963301813D-06
   1   2   3   2 -0.77764273481485D+01 -0.52308997151027D-03
   2   2   3   2 -0.57259607035419D+01 -0.36604109295222D-03
   3   2   3   2 -0.82794696875549D+01 -0.90637946367073D-15
 Band:    8
   1   1   1   1 -0.53928124615586D+01 -0.10646103004155D-14
   2   1   1   1 -0.13841871553473D+01 -0.58992177865139D-03
   3   1   1   1 -0.71493203212031D+00 -0.73337023987211D-03
   1   2   1   1  0.61680860620963D+01 -0.24891821001803D-07
   2   2   1   1  0.17161329556081D+01  0.82153331894053D-03
   3   2   1   1  0.79252706318007D+00  0.10213329654676D-02
   1   1   2   1 -0.13841871553473D+01  0.58992177865082D-03
   2   1   2   1 -0.27854300039610D+01 -0.34671769036550D-15
   3   1   2   1 -0.13475570232218D+01  0.10673571507295D-03
   1   2   2   1  0.17161330303164D+01 -0.82144909699152D-03
   2   2   2   1  0.34413615222612D+01  0.76481387641965D-07
   3   2   2   1  0.16655814836324D+01 -0.14861330803979D-03
   1   1   3   1 -0.71493203212031D+00  0.73337023987181D-03
   2   1   3   1 -0.13475570232218D+01 -0.10673571507329D-03
   3   1   3   1 -0.15295293502695D+01 -0.35953838105514D-15
   1   2   3   1  0.79252705256788D+00 -0.10212434776389D-02
   2   2   3   1  0.16655814641294D+01  0.14865424466162D-03
   3   2   3   1  0.18659687259714D+01  0.58455088616780D-07
   1   1   1   2  0.61680860620963D+01  0.24891822727636D-07
   2   1   1   2  0.17161330303164D+01  0.82144909699193D-03
   3   1   1   2  0.79252705256788D+00  0.10212434776390D-02
   1   2   1   2 -0.10750995691631D+02 -0.66993868677416D-15
   2   2   1   2 -0.27853912693855D+01 -0.73766021252697D-03
   3   2   1   2 -0.17336097664028D+01 -0.91710063850213D-03
   1   1   2   2  0.17161329556081D+01 -0.82153331894009D-03
   2   1   2   2  0.34413615222612D+01 -0.76481386759858D-07
   3   1   2   2  0.16655814641294D+01 -0.14865424466111D-03
   1   2   2   2 -0.27853912693855D+01  0.73766021252684D-03
   2   2   2   2 -0.56147940911571D+01 -0.59969932665604D-15
   3   2   2   2 -0.27278241672459D+01  0.13345539148746D-03
   1   1   3   2  0.79252706318007D+00 -0.10213329654677D-02
   2   1   3   2  0.16655814836324D+01  0.14861330804037D-03
   3   1   3   2  0.18659687259714D+01 -0.58455087888318D-07
   1   2   3   2 -0.17336097664028D+01  0.91710063850256D-03
   2   2   3   2 -0.27278241672459D+01 -0.13345539148828D-03
   3   2   3   2 -0.34530209319817D+01 -0.32798470970402D-15
