! Pwscf input file created with ciftopw.py 
! Compound: Tl2Pd3S2
&control
         calculation     = 'bands'
         prefix          = 'Tl2Pd3S2'
         restart_mode    = 'from_scratch'
         outdir          = './'
         wf_collect      = .true.
         verbosity       = 'high'
       /
&system
         ibrav           =  14
         celldm(1)       =           10.8621449847719980
         celldm(2)       =            1.0000000000000000
         celldm(3)       =            1.0000000000000000
         celldm(4)       =            0.4921197186583255
         celldm(5)       =            0.4921197186583255
         celldm(6)       =            0.4921197186583255
         nat             =        7
         ntyp            =        3
         ecutwfc         =       59.00000000
         ecutrho         =      545.00000000
         occupations     =  'smearing'  
         smearing        =  'f-d' 
         degauss         =        1.00000000e-03  
         noncolin        =  .true. 
         lspinorb        =  .true. 
/
&electrons
         conv_thr        =        1.00000000e-05 
         mixing_beta     =        3.00000000e-01    
   /
ATOMIC_SPECIES
 S  32.0650 S.rel-pbe-n-rrkjus_psl.1.0.0.UPF 
Tl 204.3833 Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF 
Pd 106.4200 Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF 
ATOMIC_POSITIONS crystal
K_POINTS crystal
249
      0.00000000       0.00000000       0.00000000 1.0 
      0.01470588       0.00000000       0.00000000 1.0 
      0.02941176       0.00000000       0.00000000 1.0 
      0.04411765       0.00000000       0.00000000 1.0 
      0.05882353       0.00000000       0.00000000 1.0 
      0.07352941       0.00000000       0.00000000 1.0 
      0.08823529       0.00000000       0.00000000 1.0 
      0.10294118       0.00000000       0.00000000 1.0 
      0.11764706       0.00000000       0.00000000 1.0 
      0.13235294       0.00000000       0.00000000 1.0 
      0.14705882       0.00000000       0.00000000 1.0 
      0.16176471       0.00000000       0.00000000 1.0 
      0.17647059       0.00000000       0.00000000 1.0 
      0.19117647       0.00000000       0.00000000 1.0 
      0.20588235       0.00000000       0.00000000 1.0 
      0.22058824       0.00000000       0.00000000 1.0 
      0.23529412       0.00000000       0.00000000 1.0 
      0.25000000       0.00000000       0.00000000 1.0 
      0.26470588       0.00000000       0.00000000 1.0 
      0.27941176       0.00000000       0.00000000 1.0 
      0.29411765       0.00000000       0.00000000 1.0 
      0.30882353       0.00000000       0.00000000 1.0 
      0.32352941       0.00000000       0.00000000 1.0 
      0.33823529       0.00000000       0.00000000 1.0 
      0.35294118       0.00000000       0.00000000 1.0 
      0.36764706       0.00000000       0.00000000 1.0 
      0.38235294       0.00000000       0.00000000 1.0 
      0.39705882       0.00000000       0.00000000 1.0 
      0.41176471       0.00000000       0.00000000 1.0 
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      0.45588235       0.00000000       0.00000000 1.0 
      0.47058824       0.00000000       0.00000000 1.0 
      0.48529412       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00000000       0.00000000 1.0 
      0.50000000       0.00899949      -0.00899949 1.0 
      0.50000000       0.01799898      -0.01799898 1.0 
      0.50000000       0.02699847      -0.02699847 1.0 
      0.50000000       0.03599796      -0.03599796 1.0 
      0.50000000       0.04499745      -0.04499745 1.0 
      0.50000000       0.05399694      -0.05399694 1.0 
      0.50000000       0.06299643      -0.06299643 1.0 
      0.50000000       0.07199592      -0.07199592 1.0 
      0.50000000       0.08099541      -0.08099541 1.0 
      0.50000000       0.08999490      -0.08999490 1.0 
      0.50000000       0.09899439      -0.09899439 1.0 
      0.50000000       0.10799388      -0.10799388 1.0 
      0.50000000       0.11699337      -0.11699337 1.0 
      0.50000000       0.12599286      -0.12599286 1.0 
      0.50000000       0.13499235      -0.13499235 1.0 
      0.50000000       0.14399184      -0.14399184 1.0 
      0.50000000       0.15299133      -0.15299133 1.0 
      0.50000000       0.16199082      -0.16199082 1.0 
      0.50000000       0.17099031      -0.17099031 1.0 
      0.50000000       0.17998980      -0.17998980 1.0 
      0.50000000       0.18898929      -0.18898929 1.0 
      0.50000000       0.19798878      -0.19798878 1.0 
      0.50000000       0.20698827      -0.20698827 1.0 
      0.50000000       0.21598776      -0.21598776 1.0 
      0.50000000       0.22498725      -0.22498725 1.0 
      0.50000000       0.23398674      -0.23398674 1.0 
      0.50000000       0.24298623      -0.24298623 1.0 
      0.50000000       0.25198572      -0.25198572 1.0 
      0.74801428       0.50000000       0.25198572 1.0 
      0.73882857       0.50000000       0.26117143 1.0 
      0.72964285       0.50000000       0.27035715 1.0 
      0.72045714       0.50000000       0.27954286 1.0 
      0.71127143       0.50000000       0.28872857 1.0 
      0.70208571       0.50000000       0.29791429 1.0 
      0.69290000       0.50000000       0.30710000 1.0 
      0.68371428       0.50000000       0.31628572 1.0 
      0.67452857       0.50000000       0.32547143 1.0 
      0.66534285       0.50000000       0.33465715 1.0 
      0.65615714       0.50000000       0.34384286 1.0 
      0.64697143       0.50000000       0.35302857 1.0 
      0.63778571       0.50000000       0.36221429 1.0 
      0.62860000       0.50000000       0.37140000 1.0 
      0.61941428       0.50000000       0.38058572 1.0 
      0.61022857       0.50000000       0.38977143 1.0 
      0.60104286       0.50000000       0.39895714 1.0 
      0.59185714       0.50000000       0.40814286 1.0 
      0.58267143       0.50000000       0.41732857 1.0 
      0.57348571       0.50000000       0.42651429 1.0 
      0.56430000       0.50000000       0.43570000 1.0 
      0.55511428       0.50000000       0.44488572 1.0 
      0.54592857       0.50000000       0.45407143 1.0 
      0.53674286       0.50000000       0.46325714 1.0 
      0.52755714       0.50000000       0.47244286 1.0 
      0.51837143       0.50000000       0.48162857 1.0 
      0.50918571       0.50000000       0.49081429 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
      0.48529412       0.48529412       0.48529412 1.0 
      0.47058824       0.47058824       0.47058824 1.0 
      0.45588235       0.45588235       0.45588235 1.0 
      0.44117647       0.44117647       0.44117647 1.0 
      0.42647059       0.42647059       0.42647059 1.0 
      0.41176471       0.41176471       0.41176471 1.0 
      0.39705882       0.39705882       0.39705882 1.0 
      0.38235294       0.38235294       0.38235294 1.0 
      0.36764706       0.36764706       0.36764706 1.0 
      0.35294118       0.35294118       0.35294118 1.0 
      0.33823529       0.33823529       0.33823529 1.0 
      0.32352941       0.32352941       0.32352941 1.0 
      0.30882353       0.30882353       0.30882353 1.0 
      0.29411765       0.29411765       0.29411765 1.0 
      0.27941176       0.27941176       0.27941176 1.0 
      0.26470588       0.26470588       0.26470588 1.0 
      0.25000000       0.25000000       0.25000000 1.0 
      0.23529412       0.23529412       0.23529412 1.0 
      0.22058824       0.22058824       0.22058824 1.0 
      0.20588235       0.20588235       0.20588235 1.0 
      0.19117647       0.19117647       0.19117647 1.0 
      0.17647059       0.17647059       0.17647059 1.0 
      0.16176471       0.16176471       0.16176471 1.0 
      0.14705882       0.14705882       0.14705882 1.0 
      0.13235294       0.13235294       0.13235294 1.0 
      0.11764706       0.11764706       0.11764706 1.0 
      0.10294118       0.10294118       0.10294118 1.0 
      0.08823529       0.08823529       0.08823529 1.0 
      0.07352941       0.07352941       0.07352941 1.0 
      0.05882353       0.05882353       0.05882353 1.0 
      0.04411765       0.04411765       0.04411765 1.0 
      0.02941176       0.02941176       0.02941176 1.0 
      0.01470588       0.01470588       0.01470588 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00000000       0.00000000       0.00000000 1.0 
      0.00917056       0.00000000      -0.00917056 1.0 
      0.01834112       0.00000000      -0.01834112 1.0 
      0.02751167      -0.00000000      -0.02751167 1.0 
      0.03668223       0.00000000      -0.03668223 1.0 
      0.04585279       0.00000000      -0.04585279 1.0 
      0.05502335      -0.00000000      -0.05502335 1.0 
      0.06419390       0.00000000      -0.06419390 1.0 
      0.07336446       0.00000000      -0.07336446 1.0 
      0.08253502       0.00000000      -0.08253502 1.0 
      0.09170558       0.00000000      -0.09170558 1.0 
      0.10087613      -0.00000000      -0.10087613 1.0 
      0.11004669      -0.00000000      -0.11004669 1.0 
      0.11921725      -0.00000000      -0.11921725 1.0 
      0.12838781       0.00000000      -0.12838781 1.0 
      0.13755836       0.00000000      -0.13755836 1.0 
      0.14672892       0.00000000      -0.14672892 1.0 
      0.15589948       0.00000000      -0.15589948 1.0 
      0.16507004       0.00000000      -0.16507004 1.0 
      0.17424059       0.00000000      -0.17424059 1.0 
      0.18341115       0.00000000      -0.18341115 1.0 
      0.19258171       0.00000000      -0.19258171 1.0 
      0.20175227      -0.00000000      -0.20175227 1.0 
      0.21092282       0.00000000      -0.21092282 1.0 
      0.22009338      -0.00000000      -0.22009338 1.0 
      0.22926394      -0.00000000      -0.22926394 1.0 
      0.23843450      -0.00000000      -0.23843450 1.0 
      0.24760505      -0.00000000      -0.24760505 1.0 
      0.25677561       0.00000000      -0.25677561 1.0 
      0.26594617       0.00000000      -0.26594617 1.0 
      0.27511673       0.00000000      -0.27511673 1.0 
      0.28428728       0.00000000      -0.28428728 1.0 
      0.29345784       0.00000000      -0.29345784 1.0 
      0.30262840       0.00000000      -0.30262840 1.0 
      0.31179896       0.00000000      -0.31179896 1.0 
      0.32096951       0.00000000      -0.32096951 1.0 
      0.33014007       0.00000000      -0.33014007 1.0 
      0.33931063       0.00000000      -0.33931063 1.0 
      0.34848119       0.00000000      -0.34848119 1.0 
      0.35765174       0.00000000      -0.35765174 1.0 
      0.36682230       0.00000000      -0.36682230 1.0 
      0.37599286       0.00000000      -0.37599286 1.0 
      0.62400714       0.37599286       0.00000000 1.0 
      0.61514949       0.38485051       0.00000000 1.0 
      0.60629183       0.39370817       0.00000000 1.0 
      0.59743418       0.40256582       0.00000000 1.0 
      0.58857653       0.41142347       0.00000000 1.0 
      0.57971888       0.42028112       0.00000000 1.0 
      0.57086122       0.42913878       0.00000000 1.0 
      0.56200357       0.43799643       0.00000000 1.0 
      0.55314592       0.44685408       0.00000000 1.0 
      0.54428826       0.45571174       0.00000000 1.0 
      0.53543061       0.46456939       0.00000000 1.0 
      0.52657296       0.47342704       0.00000000 1.0 
      0.51771531       0.48228469       0.00000000 1.0 
      0.50885765       0.49114235       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50000000       0.50000000       0.00000000 1.0 
      0.50885765       0.50885765       0.01799898 1.0 
      0.51771531       0.51771531       0.03599796 1.0 
      0.52657296       0.52657296       0.05399694 1.0 
      0.53543061       0.53543061       0.07199592 1.0 
      0.54428826       0.54428826       0.08999490 1.0 
      0.55314592       0.55314592       0.10799388 1.0 
      0.56200357       0.56200357       0.12599286 1.0 
      0.57086122       0.57086122       0.14399184 1.0 
      0.57971888       0.57971888       0.16199082 1.0 
      0.58857653       0.58857653       0.17998980 1.0 
      0.59743418       0.59743418       0.19798878 1.0 
      0.60629183       0.60629183       0.21598776 1.0 
      0.61514949       0.61514949       0.23398674 1.0 
      0.62400714       0.62400714       0.25198572 1.0 
      0.62400714       0.62400714       0.25198572 1.0 
      0.61884018       0.61884018       0.26231965 1.0 
      0.61367321       0.61367321       0.27265358 1.0 
      0.60850625       0.60850625       0.28298750 1.0 
      0.60333928       0.60333928       0.29332143 1.0 
      0.59817232       0.59817232       0.30365536 1.0 
      0.59300536       0.59300536       0.31398929 1.0 
      0.58783839       0.58783839       0.32432322 1.0 
      0.58267143       0.58267143       0.33465715 1.0 
      0.57750446       0.57750446       0.34499107 1.0 
      0.57233750       0.57233750       0.35532500 1.0 
      0.56717053       0.56717053       0.36565893 1.0 
      0.56200357       0.56200357       0.37599286 1.0 
      0.55683661       0.55683661       0.38632679 1.0 
      0.55166964       0.55166964       0.39666072 1.0 
      0.54650268       0.54650268       0.40699464 1.0 
      0.54133571       0.54133571       0.41732857 1.0 
      0.53616875       0.53616875       0.42766250 1.0 
      0.53100179       0.53100179       0.43799643 1.0 
      0.52583482       0.52583482       0.44833036 1.0 
      0.52066786       0.52066786       0.45866429 1.0 
      0.51550089       0.51550089       0.46899821 1.0 
      0.51033393       0.51033393       0.47933214 1.0 
      0.50516696       0.50516696       0.48966607 1.0 
      0.50000000       0.50000000       0.50000000 1.0 
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      0.51033393       0.01566637       0.01566637 1.0 
      0.52066786       0.03133274       0.03133274 1.0 
      0.53100179       0.04699911       0.04699911 1.0 
      0.54133571       0.06266548       0.06266548 1.0 
      0.55166964       0.07833185       0.07833185 1.0 
      0.56200357       0.09399821       0.09399821 1.0 
      0.57233750       0.10966458       0.10966458 1.0 
      0.58267143       0.12533095       0.12533095 1.0 
      0.59300536       0.14099732       0.14099732 1.0 
      0.60333928       0.15666369       0.15666369 1.0 
      0.61367321       0.17233006       0.17233006 1.0 
      0.62400714       0.18799643       0.18799643 1.0 
      0.63434107       0.20366280       0.20366280 1.0 
      0.64467500       0.21932917       0.21932917 1.0 
      0.65500893       0.23499554       0.23499554 1.0 
      0.66534285       0.25066191       0.25066191 1.0 
      0.67567678       0.26632828       0.26632828 1.0 
      0.68601071       0.28199464       0.28199464 1.0 
      0.69634464       0.29766101       0.29766101 1.0 
      0.70667857       0.31332738       0.31332738 1.0 
      0.71701250       0.32899375       0.32899375 1.0 
      0.72734642       0.34466012       0.34466012 1.0 
      0.73768035       0.36032649       0.36032649 1.0 
      0.74801428       0.37599286       0.37599286 1.0 

