vasp 
  6.2.1  
  16May21 (build Apr 11 2022 11:03:26) complex                          parallel 
  Lin64 
  2026 01 04 
  18:38:14 
 
 
  No title
       0
  Normal
  Normal (blocked Davidson)
   F  
       2
       2
       1
     200
       2
      -1
        0.00001000
       -0.02000000
       0
       2
       1
      400.00000000
        1.11000000      0.73000000      0.32000000      0.77000000
        1.00000000
        0.00100000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
      0.10700000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  Auto
       1
        0.20000000
       1
   F  
   F  
       1
 
 
  
   
    
           14.00000000       0.00000000       0.00000000 
            0.00000000      12.00000000       0.00000000 
            0.00000000       0.00000000      12.00000000 
    
       2016.00000000 
    
            0.07142857       0.00000000       0.00000000 
            0.00000000       0.08333333       0.00000000 
            0.00000000       0.00000000       0.08333333 
    
   
   
           0.62808313       0.56847791       0.50803601 
           0.66161834       0.61601059       0.38601824 
           0.66048406       0.64688791       0.61292463 
           0.68367686       0.45091883       0.53317609 
           0.42421981       0.55742577       0.49506002 
           0.58050709       0.60295565       0.24205953 
           0.53762589       0.70199938       0.34018665 
           0.61480248       0.79565296       0.17634053 
           0.72390287       0.72412576       0.20469826 
           0.67968670       0.82482149       0.30108215 
           0.65717732       0.81408406       0.56490351 
           0.54831402       0.76124213       0.62127486 
           0.63027704       0.88465706       0.75865546 
           0.73437732       0.79878996       0.75334647 
           0.62586024       0.74486248       0.80967748 
           0.62981436       0.30545713       0.46422854 
           0.69115349       0.39391609       0.36839177 
           0.78963350       0.22641776       0.41761823 
           0.78601906       0.26530122       0.56121668 
           0.84659398       0.35162763       0.46289507 
           0.35337909       0.55398271       0.48655111 
           0.60247771       0.66815073       0.30127518 
           0.65877069       0.75834842       0.24284279 
           0.62641603       0.76003210       0.63002972 
           0.65618493       0.79893840       0.74465826 
           0.69213797       0.36019079       0.45362524 
           0.78408775       0.29754479       0.47558222 
   
  
  
           1 
           2 
           3 
           4 
           5 
           6 
           7 
           8 
           9 
          10 
          11 
          12 
          13 
          14 
          15 
          16 
          17 
          18 
          19 
          20 
          21 
          22 
          23 
          24 
          25 
          26 
          27 
  
 
 
  
          1        2        2 
         0.00000000       0.00000000       0.00000000 
         1.00000000       0.00000000       0.00000000 
         0.00000000       0.50000000       0.00000000 
         0.00000000       0.00000000       0.50000000 
         0.00000000       0.00000000       0.00000000 
  
  
          0.00000000       0.00000000       0.00000000 
          0.00000000       0.50000000       0.00000000 
          0.00000000       0.00000000       0.50000000 
          0.00000000       0.50000000       0.50000000 
  
  
          0.25000000 
          0.25000000 
          0.25000000 
          0.25000000 
  
 
 
  
   No title
    F  
  
  
   normal
       400.00000000
       644.87300000
         0.00001000
       38
       10
       48
       -1
       -1
        63.00000000
        0
        0
        0
        0
         0.00000000
   
         1
          0.20000000
          0.50000000
     T  
     T  
   
   
     T  
         -0.00050000     -0.00050000     -0.00050000     -0.00050000
      -100
         2
     F  
   
   
         0
         2
         1
   
   
         2
     F  
          0.00100000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
      0.10700000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
          1.00000000
     F  
          0.00000000      0.00000000      1.00000000
     F  
          0.00000000      0.00000000      0.00000000
     F  
   
   
     F  
     F  
   
   
       200
        -5
         2
        400.00000000
    
      T  
      F  
           0.00000000
           0.00000005
           0.30000000
          4
           0.40000000
    
   
   
          0.40000000
          1.00000000
          0.10000000
          1.60000000
          1.00000000
    
          4
      F  
        -45
         100.00000000
          1
          1
          5
    
   
   
     F  
     F  
         0
          1.00000000
       -100.00000000   -100.00000000   -100.00000000
          0.00000000
   
  
  
       70
       60
       60
      140
      120
      120
    F  
  
  
        0
       -1
        0
        2
         0.00000000
        -0.02000000
        0
         0.50000000
        -3.00000000
         1.00000000
  
  
         0.00010000
         0.00010000
        1
        1
      256
        16.00000000
  
  
        2
         0.00001000
  
  
        0
         1.11000000      0.73000000      0.32000000      0.77000000
      301
        10.00000000
       -10.00000000
         0.00000000
  
  
        1
    F  
    F  
    F  
    F  
    F  
    F  
    F  
    F  
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
        4
        4
       -1
    T  
    F  
    F  
    F  
    F  
    F  
  
  
        3
       -1
    F  
        28.08500000     16.00000000      1.00000000     12.01100000
         0.00000000      0.00000000      0.00000000      0.00000000
         1.00000000      1.00000000      1.00000000      1.00000000
    T  
  
   T  
   F  
       0
   F  
       0
  
   --
        1
    F  
   
    F  
    F  
    F  
    F  
    F  
        -1.00000000
        0
        0
         0.00000000
         0.00000000
         0.00000000
         1.00000000
         1.00000000
         1.00000000
         1.00000000
        1
        1
        1
    F  
    F  
    F  
        0
        0
    F  
         0.00000000
         0.00000000
        0
  
  
    F  
        -0.84910000
         0.12340000
         1.00000000
         0.00000000
  
  
        0
        44.80000000
         1.00000000
  
  
    F  
    F  
    F  
    F  
        0
         0.10000000
        -1.00000000
         0.00200000
        -0.10000000
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000      0.00000000
  
  
    F  
         0.00000000      0.00000000      0.00000000
    T  
    F  
    F  
    F  
    T  
        0
         0.00000000      0.00000000      0.00000000
         0.00000000      0.00000000      0.00000000
  
  
    F  
    F  
    F  
    F  
    T  
        0
       -1     0     0     0
    F  
    F  
    F  
    F  
    F  
    F  
        2
    F  
    F  
    F  
    F  
    F  
    F  
        -2.00000000
        -2.00000000
        -1.00000000
    F  
       -1
         0.00000000
        0
        0
       -1
       -1
       -1
      200
        1
        3
        4
        0
       -30.00000000
       -30.00000000
      -200.00000000
        0
        -0.10000000
    F  
    F  
    F  
    F  
    F  
    F  
    F  
        1
        1
        1
     2800
        0
       -1
       -1
         0.80000001
         1.00000000
  
  
         0.00000000
         0.00000000      0.00000000      0.00000000
         0.00000000
         0.00000000
         0.00000000
  
  
    F  
  
 
 
        27 
         4 
  
   ion
   element
   atomtype
   
    Si   1
    O    2
    O    2
    O    2
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    H    3
    C    4
    C    4
    C    4
    C    4
    C    4
    C    4
   
  
  
   type
   atomspertype
   element
   mass
   valence
   pseudopotential
   
       1Si     28.08500000      4.00000000  PAW_PBE Si 05Jan2001                  
       3O      16.00000000      6.00000000  PAW_PBE O 08Apr2002                   
      17H       1.00000000      1.00000000  PAW_PBE H 15Jun2001                   
       6C      12.01100000      4.00000000  PAW_PBE C 08Apr2002                   
   
  
 
 
  
   
          14.00000000       0.00000000       0.00000000 
           0.00000000      12.00000000       0.00000000 
           0.00000000       0.00000000      12.00000000 
   
      2016.00000000 
   
           0.07142857       0.00000000       0.00000000 
           0.00000000       0.08333333       0.00000000 
           0.00000000       0.00000000       0.08333333 
   
  
  
          0.62808313       0.56847791       0.50803601 
          0.66161834       0.61601059       0.38601824 
          0.66048406       0.64688791       0.61292463 
          0.68367686       0.45091883       0.53317609 
          0.42421981       0.55742577       0.49506002 
          0.58050709       0.60295565       0.24205953 
          0.53762589       0.70199938       0.34018665 
          0.61480248       0.79565296       0.17634053 
          0.72390287       0.72412576       0.20469826 
          0.67968670       0.82482149       0.30108215 
          0.65717732       0.81408406       0.56490351 
          0.54831402       0.76124213       0.62127486 
          0.63027704       0.88465706       0.75865546 
          0.73437732       0.79878996       0.75334647 
          0.62586024       0.74486248       0.80967748 
          0.62981436       0.30545713       0.46422854 
          0.69115349       0.39391609       0.36839177 
          0.78963350       0.22641776       0.41761823 
          0.78601906       0.26530122       0.56121668 
          0.84659398       0.35162763       0.46289507 
          0.35337909       0.55398271       0.48655111 
          0.60247771       0.66815073       0.30127518 
          0.65877069       0.75834842       0.24284279 
          0.62641603       0.76003210       0.63002972 
          0.65618493       0.79893840       0.74465826 
          0.69213797       0.36019079       0.45362524 
          0.78408775       0.29754479       0.47558222 
  
 
 
  
       6.34    6.51
       6.89    7.05
   
          7.57899788 
       2872.38581680 
      -4708.18899854 
        191.73299161 
       1815.17967868 
      -1806.54975558 
         -0.01906398 
       -450.64714360 
       2494.75543287 
        416.22795614 
        416.24702011 
        416.23431080 
   
  
  
       8.34    8.34
       8.34    8.34
   
        -12.63793838 
        -12.64476276 
        -12.64021317 
   
  
  
       6.84    6.85
       6.84    6.85
   
       -148.18930551 
       -148.20227089 
       -148.19362730 
   
  
  
       7.02    7.03
       7.02    7.03
   
       -157.04815107 
       -157.06808575 
       -157.05479596 
   
  
  
       7.05    7.06
       7.12    7.13
   
       -157.26855859 
       -157.28886809 
       -157.27532842 
   
  
  
       6.11    6.13
       6.64    6.66
   
       -145.02284607 
       -145.03465830 
       -145.02678348 
   
  
  
       6.15    6.16
       6.65    6.66
   
       -142.85393749 
       -142.86599547 
       -142.85795682 
   
  
  
       6.03    6.04
       6.55    6.56
   
       -142.52901901 
       -142.54130660 
       -142.53311487 
   
  
  
       6.34    6.36
       6.84    6.86
   
       -142.50001171 
       -142.51219970 
       -142.50407437 
   
  
  
       6.03    6.08
       6.60    6.74
   
       -142.50040270 
       -142.51244383 
       -142.50441641