
 **** 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  5.00000000E-01  5.00000000E-01  0.00000000E+00 1.0
 K-point:  0.00000000E+00  0.00000000E+00  0.00000000E+00
 Band:    1
   1   1   1   1 -0.76987282568148D-03 -0.11911400820764D-21
   2   1   1   1 -0.38687548738942D-03  0.66068785518266D-04
   3   1   1   1 -0.36344156608322D-03  0.66078251264137D-04
   1   2   1   1 -0.75985887761954D-02  0.97531745349915D-06
   2   2   1   1  0.82007167009150D-02  0.10372651045916D-01
   3   2   1   1 -0.12729129880945D-01  0.10373117674146D-01
   1   1   2   1 -0.38687548738942D-03 -0.66068785518266D-04
   2   1   2   1 -0.85022417611306D-03  0.84703294725430D-20
   3   1   2   1 -0.44381823612393D-03 -0.66057023443279D-04
   1   2   2   1  0.81969682098083D-02 -0.10370391167228D-01
   2   2   2   1 -0.20215951727006D-01  0.12822062961517D-05
   3   2   2   1 -0.25346934674376D-01 -0.10369914157000D-01
   1   1   3   1 -0.36344156608322D-03 -0.66078251264137D-04
   2   1   3   1 -0.44381823612393D-03  0.66057023443279D-04
   3   1   3   1 -0.80726884351750D-03 -0.73472189373974D-20
   1   2   3   1 -0.12730590093997D-01 -0.10370120223028D-01
   2   2   3   1 -0.25348388655017D-01  0.10372898268463D-01
   3   2   3   1 -0.38077780203206D-01  0.28096672170369D-09
   1   1   1   2 -0.75985887761954D-02 -0.97531745349886D-06
   2   1   1   2  0.81969682098083D-02  0.10370391167228D-01
   3   1   1   2 -0.12730590093997D-01  0.10370120223028D-01
   1   2   1   2 -0.31746154340346D+01  0.46837533851374D-16
   2   2   1   2 -0.51830041110589D+00  0.16281324680742D+01
   3   2   1   2 -0.21752001852745D+01  0.16279443436393D+01
   1   1   2   2  0.82007167009150D-02 -0.10372651045916D-01
   2   1   2   2 -0.20215951727006D-01 -0.12822062961512D-05
   3   1   2   2 -0.25348388655017D-01 -0.10372898268463D-01
   1   2   2   2 -0.51830041110589D+00 -0.16281324680743D+01
   2   2   2   2 -0.51559467547542D+01  0.13877787807814D-16
   3   2   2   2 -0.41559839099563D+01 -0.16283631756966D+01
   1   1   3   2 -0.12729129880945D-01 -0.10373117674146D-01
   2   1   3   2 -0.25346934674376D-01  0.10369914157000D-01
   3   1   3   2 -0.38077780203206D-01 -0.28096672192878D-09
   1   2   3   2 -0.21752001852745D+01 -0.16279443436393D+01
   2   2   3   2 -0.41559839099563D+01  0.16283631756966D+01
   3   2   3   2 -0.63309587595635D+01 -0.17995294373756D-16
 Band:    2
   1   1   1   1 -0.13460433124790D+00 -0.24833682524516D-17
   2   1   1   1 -0.79644818608595D-01  0.12020847871580D-05
   3   1   1   1 -0.15934234840928D+00  0.63669922644868D-06
   1   2   1   1  0.76919824062044D-01 -0.18136606319892D-05
   2   2   1   1  0.36757417240775D+00 -0.94400618946526D-05
   3   2   1   1 -0.23012453689989D+00 -0.10415040430512D-04
   1   1   2   1 -0.79644818608595D-01 -0.12020847871626D-05
   2   1   2   1 -0.15986484824310D+00 -0.41367037735981D-17
   3   1   2   1 -0.19238695821230D+00 -0.31578318392300D-05
   1   2   2   1  0.37128374293163D+00  0.13576888036836D-05
   2   2   2   1  0.36200115096755D-01 -0.62730529800026D-05
   3   2   2   1 -0.27285864738861D+00 -0.20388511540107D-05
   1   1   3   1 -0.15934234840928D+00 -0.63669922645608D-06
   2   1   3   1 -0.19238695821230D+00  0.31578318392203D-05
   3   1   3   1 -0.47048541035007D+00 -0.74462997265371D-17
   1   2   3   1 -0.17353029819615D+00  0.22914598009563D-05
   2   2   3   1 -0.21626440598757D+00 -0.60893537733292D-05
   3   2   3   1 -0.47712133219758D+00  0.16388802354924D-07
   1   1   1   2  0.76919824062044D-01  0.18136606320209D-05
   2   1   1   2  0.37128374293163D+00 -0.13576888036355D-05
   3   1   1   2 -0.17353029819615D+00 -0.22914598008754D-05
   1   2   1   2 -0.20190597252607D+02 -0.15538395900907D-16
   2   2   1   2 -0.88783791805223D+01 -0.10724839465298D-03
   3   2   1   2 -0.84892695322391D+01 -0.31838051053592D-04
   1   1   2   2  0.36757417240775D+00  0.94400618946726D-05
   2   1   2   2  0.36200115096755D-01  0.62730529800308D-05
   3   1   2   2 -0.21626440598757D+00  0.60893537733808D-05
   1   2   2   2 -0.88783791805224D+01  0.10724839465287D-03
   2   2   2   2 -0.20824447237382D+02  0.14639461009809D-15
   3   2   2   2 -0.95532019352768D+01  0.36851545353634D-03
   1   1   3   2 -0.23012453689989D+00  0.10415040430461D-04
   2   1   3   2 -0.27285864738861D+00  0.20388511539774D-05
   3   1   3   2 -0.47712133219758D+00 -0.16388802386692D-07
   1   2   3   2 -0.84892695322391D+01  0.31838051053835D-04
   2   2   3   2 -0.95532019352768D+01 -0.36851545353592D-03
   3   2   3   2 -0.24603914630768D+02 -0.29436197509078D-15
 Band:    3
   1   1   1   1 -0.11811245675693D+00 -0.12061352122207D-17
   2   1   1   1 -0.91753718204522D-01 -0.32543448184692D-05
   3   1   1   1 -0.49742814244065D-01 -0.36070040116057D-06
   1   2   1   1  0.25667218272367D+00  0.92899551448555D-05
   2   2   1   1  0.45128529993443D+00  0.81912340708421D-05
   3   2   1   1 -0.21278050507617D+00  0.13222762027087D-04
   1   1   2   1 -0.91753718204522D-01  0.32543448184694D-05
   2   1   2   1 -0.38932451887113D+00 -0.29479393542410D-17
   3   1   2   1 -0.10559112467377D+00  0.38332409035328D-05
   1   2   2   1  0.34865212028151D+00  0.29730155151647D-05
   2   2   2   1  0.12871495547316D+00  0.18693159957717D-05
   3   2   2   1 -0.28500492655101D+00  0.39698477798522D-05
   1   1   3   1 -0.49742814244065D-01  0.36070040115958D-06
   2   1   3   1 -0.10559112467377D+00 -0.38332409035338D-05
   3   1   3   1 -0.11759228185002D+00 -0.39224242902775D-18
   1   2   3   1 -0.23076640319992D+00 -0.21115896964651D-05
   2   2   3   1 -0.30299074404161D+00  0.71112738325718D-05
   3   2   3   1 -0.50600449034530D+00 -0.34936887631843D-08
   1   1   1   2  0.25667218272367D+00 -0.92899551448444D-05
   2   1   1   2  0.34865212028151D+00 -0.29730155151871D-05
   3   1   1   2 -0.23076640319992D+00  0.21115896964672D-05
   1   2   1   2 -0.19185634686067D+02  0.44106487871189D-16
   2   2   1   2 -0.13984383728513D+02  0.37547605977522D-03
   3   2   1   2 -0.11779436158869D+02 -0.11484256330996D-04
   1   1   2   2  0.45128529993443D+00 -0.81912340708033D-05
   2   1   2   2  0.12871495547316D+00 -0.18693159958180D-05
   3   1   2   2 -0.30299074404161D+00 -0.71112738325886D-05
   1   2   2   2 -0.13984383728513D+02 -0.37547605977595D-03
   2   2   2   2 -0.32882925379233D+02 -0.10558771789711D-14
   3   2   2   2 -0.13577575947799D+02 -0.45310843314346D-03
   1   1   3   2 -0.21278050507617D+00 -0.13222762027095D-04
   2   1   3   2 -0.28500492655101D+00 -0.39698477798479D-05
   3   1   3   2 -0.50600449034530D+00  0.34936887726618D-08
   1   2   3   2 -0.11779436158869D+02  0.11484256331231D-04
   2   2   3   2 -0.13577575947799D+02  0.45310843314362D-03
   3   2   3   2 -0.23271733062979D+02  0.45934930248824D-15
 Band:    4
   1   1   1   1 -0.43407236780372D+00 -0.57135813363651D-17
   2   1   1   1 -0.15844647089864D+00  0.20534540733962D-05
   3   1   1   1 -0.14785900885398D+00 -0.27944490028740D-06
   1   2   1   1  0.16080732829866D+00 -0.74817329488045D-05
   2   2   1   1  0.39461366438297D+00  0.12554636860011D-05
   3   2   1   1 -0.27616876328800D+00 -0.27982591760978D-05
   1   1   2   1 -0.15844647089864D+00 -0.20534540733979D-05
   2   1   2   1 -0.13759980053767D+00 -0.23196592830600D-17
   3   1   2   1 -0.58966088488676D-01 -0.67862565731663D-06
   1   2   2   1  0.49353729103212D+00 -0.43220502408794D-05
   2   2   2   1  0.32948424282268D+00  0.44140457703370D-05
   3   2   2   1 -0.16121023540667D+00 -0.19311856725354D-05
   1   1   3   1 -0.14785900885398D+00  0.27944490028073D-06
   2   1   3   1 -0.58966088488676D-01  0.67862565731565D-06
   3   1   3   1 -0.12581060772380D+00 -0.12505051802781D-17
   1   2   3   1 -0.31477654970516D+00 -0.34612719434295D-06
   2   2   3   1 -0.19981809811714D+00 -0.11916993844539D-05
   3   2   3   1 -0.45502169133996D+00 -0.10830218202769D-07
   1   1   1   2  0.16080732829866D+00  0.74817329487734D-05
   2   1   1   2  0.49353729103212D+00  0.43220502409235D-05
   3   1   1   2 -0.31477654970516D+00  0.34612719433309D-06
   1   2   1   2 -0.34842009192383D+02 -0.87001189232213D-15
   2   2   1   2 -0.15749701002217D+02 -0.26842051418835D-03
   3   2   1   2 -0.15337071300967D+02  0.43063633491945D-04
   1   1   2   2  0.39461366438297D+00 -0.12554636860247D-05
   2   1   2   2  0.32948424282268D+00 -0.44140457703311D-05
   3   1   2   2 -0.19981809811714D+00  0.11916993844629D-05
   1   2   2   2 -0.15749701002217D+02  0.26842051418806D-03
   2   2   2   2 -0.20510867914533D+02  0.12929132082713D-15
   3   2   2   2 -0.12474999197524D+02  0.84528742151268D-04
   1   1   3   2 -0.27616876328800D+00  0.27982591761038D-05
   2   1   3   2 -0.16121023540667D+00  0.19311856725202D-05
   3   1   3   2 -0.45502169133996D+00  0.10830218210085D-07
   1   2   3   2 -0.15337071300967D+02 -0.43063633491877D-04
   2   2   3   2 -0.12474999197524D+02 -0.84528742151151D-04
   3   2   3   2 -0.23335906246942D+02  0.23828254416125D-15
 Band:    5
   1   1   1   1 -0.28153523850674D+00 -0.46620693416877D-17
   2   1   1   1 -0.16185419765662D+00  0.66695853443820D-01
   3   1   1   1 -0.99952877612285D-01  0.66698006231208D-01
   1   2   1   1  0.24677053974376D-01 -0.34100913473929D-05
   2   2   1   1  0.26709804969464D-01 -0.74818213637843D-01
   3   2   1   1 -0.24162979522784D-01 -0.74817219219355D-01
   1   1   2   1 -0.16185419765662D+00 -0.66695853443820D-01
   2   1   2   1 -0.36267011395009D+00  0.28189256484623D-17
   3   1   2   1 -0.18109357045411D+00 -0.66693174197221D-01
   1   2   2   1  0.26724080006210D-01  0.74810154023551D-01
   2   2   2   1  0.11570233392934D+00 -0.46504312921029D-05
   3   2   2   1  0.66855095367542D-01  0.74811859084878D-01
   1   1   3   1 -0.99952877612285D-01 -0.66698006231208D-01
   2   1   3   1 -0.18109357045411D+00  0.66693174197221D-01
   3   1   3   1 -0.28104859328159D+00 -0.84859503648208D-17
   1   2   3   1 -0.24157533433861D-01  0.74805590572843D-01
   2   2   3   1  0.66860528347360D-01 -0.74823479325178D-01
   3   2   3   1  0.42695037069990D-01 -0.87056996368010D-08
   1   1   1   2  0.24677053974376D-01  0.34100913473977D-05
   2   1   1   2  0.26724080006210D-01 -0.74810154023551D-01
   3   1   1   2 -0.24157533433861D-01 -0.74805590572843D-01
   1   2   1   2 -0.29776749935532D+00 -0.26020852139652D-17
   2   2   1   2 -0.69262806463207D-01  0.83920807329185D-01
   3   2   1   2 -0.20370452535497D+00  0.83911913030756D-01
   1   1   2   2  0.26709804969464D-01  0.74818213637843D-01
   2   1   2   2  0.11570233392934D+00  0.46504312921150D-05
   3   1   2   2  0.66860528347360D-01  0.74823479325178D-01
   1   2   2   2 -0.69262806463207D-01 -0.83920807329185D-01
   2   2   2   2 -0.39989135860813D+00 -0.34694469519536D-17
   3   2   2   2 -0.30580235518693D+00 -0.83931711865319D-01
   1   1   3   2 -0.24162979522784D-01  0.74817219219355D-01
   2   1   3   2  0.66855095367542D-01 -0.74811859084878D-01
   3   1   3   2  0.42695037069990D-01  0.87056996412632D-08
   1   2   3   2 -0.20370452535497D+00 -0.83911913030756D-01
   2   2   3   2 -0.30580235518693D+00  0.83931711865319D-01
   3   2   3   2 -0.50949609922978D+00 -0.16778548088638D-17
 Band:    6
   1   1   1   1 -0.65291977685942D+00 -0.25500435096859D-15
   2   1   1   1 -0.67419751066755D+00  0.51936059130328D+00
   3   1   1   1  0.29740204084509D+00 -0.12455037171261D+00
   1   2   1   1  0.42294082655385D-01 -0.51952607468050D+00
   2   2   1   1 -0.25565868731238D+00  0.91540542371733D+00
   3   2   1   1  0.12445084747660D+01 -0.34388645064365D+00
   1   1   2   1 -0.67419751066755D+00 -0.51936059130328D+00
   2   1   2   1 -0.17235754514209D+01 -0.18735013540550D-15
   3   1   2   1  0.55495721248839D+00  0.40528513194305D+00
   1   2   2   1  0.80151819437740D+00 -0.68858860577254D+00
   2   2   2   1 -0.16980182982001D+01  0.74634753445270D+00
   3   2   2   1  0.20793130292192D+01  0.11200517737403D+01
   1   1   3   1  0.29740204084509D+00  0.12455037171261D+00
   2   1   3   1  0.55495721248839D+00 -0.40528513194305D+00
   3   1   3   1 -0.94389967258107D+00 -0.38811737857462D-16
   1   2   3   1 -0.12358732552527D+00  0.57058034063050D+00
   2   2   3   1  0.71157892764234D+00 -0.89337984681443D+00
   3   2   3   1 -0.14308690263818D+01 -0.27232916581763D-03
   1   1   1   2  0.42294082655384D-01  0.51952607468049D+00
   2   1   1   2  0.80151819437740D+00  0.68858860577254D+00
   3   1   1   2 -0.12358732552527D+00 -0.57058034063050D+00
   1   2   1   2 -0.19386425512151D+01 -0.25587171270658D-15
   2   2   1   2  0.53955705791486D+00  0.46715738541784D+00
   3   2   1   2 -0.98369918866277D+00 -0.15764197894423D+01
   1   1   2   2 -0.25565868731238D+00 -0.91540542371733D+00
   2   1   2   2 -0.16980182982001D+01 -0.74634753445270D+00
   3   1   2   2  0.71157892764234D+00  0.89337984681443D+00
   1   2   2   2  0.53955705791486D+00 -0.46715738541784D+00
   2   2   2   2 -0.39310045832960D+01  0.40245584642662D-15
   3   2   2   2  0.12589682629890D+01  0.24684787572436D+01
   1   1   3   2  0.12445084747660D+01  0.34388645064365D+00
   2   1   3   2  0.20793130292192D+01 -0.11200517737403D+01
   3   1   3   2 -0.14308690263818D+01  0.27232916581728D-03
   1   2   3   2 -0.98369918866277D+00  0.15764197894423D+01
   2   2   3   2  0.12589682629890D+01 -0.24684787572436D+01
   3   2   3   2 -0.55311894841085D+01  0.30100840439987D-15
 Band:    7
   1   1   1   1 -0.15723598348086D+01 -0.63577615394550D-15
   2   1   1   1 -0.76561278223323D+00 -0.11718319188017D+01
   3   1   1   1 -0.13938531762722D+01  0.11688803490057D+00
   1   2   1   1 -0.27225198312913D+01  0.10402422372301D+01
   2   2   1   1 -0.10555506104202D+01 -0.21975934053746D+01
   3   2   1   1 -0.31107115093430D+01  0.32323396236159D+00
   1   1   2   1 -0.76561278223323D+00  0.11718319188017D+01
   2   1   2   1 -0.17030332661737D+01 -0.47184478546569D-15
   3   1   2   1 -0.64216036664620D+00  0.11459355568734D+01
   1   2   2   1 -0.40879541110946D+00  0.32169395127205D+01
   2   2   2   1 -0.25096391706338D+01 -0.20874466927750D-01
   3   2   2   1 -0.12734240889398D+01  0.31663588665749D+01
   1   1   3   1 -0.13938531762722D+01 -0.11688803490057D+00
   2   1   3   1 -0.64216036664620D+00 -0.11459355568734D+01
   3   1   3   1 -0.14419940834920D+01  0.35275205896086D-15
   1   2   3   1 -0.26995626110160D+01  0.69635347146952D+00
   2   2   3   1 -0.86245082139916D+00 -0.21470089576404D+01
   3   2   3   1 -0.29171318565558D+01  0.22339335543010D-03
   1   1   1   2 -0.27225198312913D+01 -0.10402422372301D+01
   2   1   1   2 -0.40879541110946D+00 -0.32169395127205D+01
   3   1   1   2 -0.26995626110160D+01 -0.69635347146952D+00
   1   2   1   2 -0.86907171018886D+01  0.16237011735143D-14
   2   2   1   2 -0.16253650690499D+01 -0.60145708946452D+01
   3   2   1   2 -0.83300770028462D+01 -0.19235616709740D+01
   1   1   2   2 -0.10555506104202D+01  0.21975934053746D+01
   2   1   2   2 -0.25096391706338D+01  0.20874466927749D-01
   3   1   2   2 -0.86245082139916D+00  0.21470089576404D+01
   1   2   2   2 -0.16253650690499D+01  0.60145708946452D+01
   2   2   2   2 -0.63760876282935D+01  0.55511151231258D-16
   3   2   2   2 -0.31295775102323D+01  0.59322743475629D+01
   1   1   3   2 -0.31107115093430D+01 -0.32323396236159D+00
   2   1   3   2 -0.12734240889398D+01 -0.31663588665749D+01
   3   1   3   2 -0.29171318565558D+01 -0.22339335543026D-03
   1   2   3   2 -0.83300770028462D+01  0.19235616709740D+01
   2   2   3   2 -0.31295775102323D+01 -0.59322743475629D+01
   3   2   3   2 -0.94860209771331D+01 -0.29520927802978D-14
 Band:    8
   1   1   1   1 -0.42477186852445D+01  0.83266726846887D-16
   2   1   1   1 -0.24893676554628D+01 -0.37742956620818D+00
   3   1   1   1 -0.11426357115396D+01 -0.10223195518858D+01
   1   2   1   1 -0.65391749975110D+01 -0.52053706965370D+00
   2   2   1   1 -0.23137667981026D+01 -0.15630722664469D+01
   3   2   1   1 -0.28872489777580D+01 -0.28245216107100D+01
   1   1   2   1 -0.24893676554628D+01  0.37742956620818D+00
   2   1   2   1 -0.17932124078290D+01 -0.20469737016526D-15
   3   1   2   1 -0.89893530618040D+00 -0.52141964416769D+00
   1   2   2   1 -0.40171868551156D+01  0.31731451926275D+00
   2   2   2   1 -0.15502399844925D+01 -0.72525298820176D+00
   3   2   2   1 -0.20975875167842D+01 -0.14406399001161D+01
   1   1   3   1 -0.11426357115396D+01  0.10223195518858D+01
   2   1   3   1 -0.89893530618040D+00  0.52141964416769D+00
   3   1   3   1 -0.83942118812704D+00  0.40496195221975D-16
   1   2   3   1 -0.19301003221789D+01  0.15786413568074D+01
   2   2   3   1 -0.11406248616537D+01  0.19501572871263D+00
   3   2   3   1 -0.16968483122554D+01  0.43048750830957D-04
   1   1   1   2 -0.65391749975110D+01  0.52053706965370D+00
   2   1   1   2 -0.40171868551156D+01 -0.31731451926275D+00
   3   1   1   2 -0.19301003221789D+01 -0.15786413568074D+01
   1   2   1   2 -0.12716430458487D+02 -0.14432899320127D-14
   2   2   1   2 -0.48783505244296D+01 -0.23142696231657D+01
   3   2   1   2 -0.57434808758298D+01 -0.43613917725585D+01
   1   1   2   2 -0.23137667981026D+01  0.15630722664469D+01
   2   1   2   2 -0.15502399844925D+01  0.72525298820176D+00
   3   1   2   2 -0.11406248616537D+01 -0.19501572871263D+00
   1   2   2   2 -0.48783505244296D+01  0.23142696231657D+01
   2   2   2   2 -0.34751392771350D+01  0.61756155744774D-15
   3   2   2   2 -0.36222170653551D+01 -0.53868677048226D+00
   1   1   3   2 -0.28872489777580D+01  0.28245216107100D+01
   2   1   3   2 -0.20975875167842D+01  0.14406399001161D+01
   3   1   3   2 -0.16968483122554D+01 -0.43048750831500D-04
   1   2   3   2 -0.57434808758298D+01  0.43613917725585D+01
   2   2   3   2 -0.36222170653551D+01  0.53868677048226D+00
   3   2   3   2 -0.55325301280819D+01 -0.18093470786299D-14
