H GEN 0 1
3
1.00000000000000    1 21.24359508259891 
21.24359508259891   3 21.24359508259891 
-10.85192405303825  2 21.77696655044365 
1
0.00000000000000    2 1.000000000000000 

B GEN 2 1
3
 3.00000   1 31.49298
 94.47895  3 22.56509
-9.74800   2 8.64669 
1
 20.74800  2 4.06246 

C GEN 2 1 
3
 4.00000  1 14.43502
57.74008  3 8.39889 
-25.81955 2 7.38188 
1
52.13345  2 7.76079 

N GEN 2 1
6
  3.25000    1  12.91881  
  1.75000    1  9.22825   
  41.98612   3  12.96581  
  16.14945   3  8.05477   
 -26.09522   2  12.54876  
 -10.32626   2  7.53360   
2
  34.77692   2  9.41609   
  15.20330   2  8.16694

O GEN 2 1
3
  6.000000 1  12.30997
  73.85984 3  14.76962
 -47.87600 2  13.71419
1
  85.86406 2  13.65512

F GEN 2 1
3
7.0 1 11.3954401213
79.7680808491 3 10.49201883
-49.4990068225 2 10.2868054098
1
51.3934743997 2 11.3903478843

Na GEN 10 2
3
  1.000000  1 4.311678 
  4.311678  3 1.925689 
 -2.083137  2 1.549498 
2
  6.234064  2 5.377666 
  9.075931  2 1.408414 
2
  3.232724  2 1.379949 
  2.494079  2 0.862453 

Mg GEN 10 2
3
  2.000000 1 6.048538 
 12.097075 3 2.796989 
-17.108313 2 2.547408 
2
  6.428631 2 5.936017 
 14.195491 2 1.592891 
2
  3.315069 2 1.583969 
  4.403025 2 1.077297 

Al GEN 2 1
3
  11.000000 1 11.062056                   
 121.682619 3 12.369778                   
 -82.624567 2 11.965444                   
2
  25.157259 2 81.815564                   
 113.067525 2 24.522883    

Si GEN 10 2
3
   4.000000 1 5.168316
  20.673264 3 8.861690
 -14.818174 2 3.933474
2
  14.832760 2 9.447023
  26.349664 2 2.553812
2
   7.621400 2 3.660001
  10.331583 2 1.903653

P GEN 2 1
3
   13.000000 1 15.073300
  195.952906 3 18.113176
 -117.611086 2 17.371539
2
  25.197230 2 101.982019
 189.426261 2  37.485881

S GEN 2 1
3
   14.000000 1 17.977612
  251.686565 3 20.435964
 -135.538891 2 19.796579
2
  25.243283 2 111.936344 
 227.060768 2  43.941844

Cl GEN 2 1
3
   15.000000 1 22.196266
  332.943994 3 26.145117
 -161.999982 2 25.015118
2
  26.837357 2 124.640433 
 277.296696 2  52.205433

Ar GEN 2 1
3
   16.000000 1  23.431337
  374.901386 3  26.735872
 -178.039517 2  26.003325
2
   25.069215 2 135.620522 
  332.151842 2  60.471053

Sc GEN 10 2
4
   11.00000000 1 16.02394388
  176.26338271 3 14.08647403
  -83.68149599 2 11.93985121
    0.43282764 2  3.69440111
2
  153.96530175 2 11.49466541
   14.93675657 2  5.01031394
2
   97.21725690 2 11.45126730
   10.81704018 2  4.76798446

Ti GEN 10 2
4
  12.00000000 1 18.41366202
 220.96394426 3 15.92292414
 -94.29025824 2 13.65000623
   0.09791142 2  5.09555210
2
 173.94657235 2 12.70580613
  18.83768333 2  6.11178551
2
 111.45672882 2 12.64091929
  11.17702682 2  5.35437415

V GEN 10 2
4
   13.00000000 1 20.32168914
  264.18195885 3 19.59698040
 -115.29293208 2 17.33147348
   -0.66288726 2  5.12320657
2
  195.56713891 2 15.12502150
   22.88642834 2  6.29898914
2
  126.42119500 2 15.93855113
   16.03597127 2  5.74006266

Cr GEN 10 2
4
   14.00000000 1 18.28091074
  255.93275041 3 17.09800655
 -132.01826317 2 16.72267276
   -0.77388761 2  5.02865105
2
  219.48146209 2 16.90078760
   28.07933176 2  7.33662150
2
  139.98396871 2 17.31974516
   19.54835786 2  6.92409757

Mn GEN 10 2
4
   15.00000000 1 21.91937433
  328.79061500 3 21.35527127
 -162.05172805 2 21.27162653
   -1.82694272 2  7.93913962
2
  244.66870492 2 18.92044965
   33.54162717 2  8.32764757
2
  162.35033685 2 20.17347020
   24.17956695 2  7.80047874

Fe GEN 10 2
4
   16.00000000 1 23.22091713
  371.53467417 3 23.54714679
 -181.22603445 2 23.47256344
   -2.37305236 2  9.85238815
2
  277.50032547 2 22.21062697
   46.20495585 2  9.51515800
2
  194.99875056 2 24.57000871
   31.67945132 2  8.86648776

Co GEN 10 2
4
   17.00000000 1 25.00124115
  425.02109971 3 22.83490096
 -195.48211282 2 23.47468155
   -2.81572866 2 10.33794825
2              
  271.77708486 2 23.41427030
   54.26461121 2 10.76931694
2
  201.53430745 2 25.47446316
   38.99231927 2 10.68404901

Ni GEN 10 2
4
  18.000                 1 2.82630001015327e+01
  508.7340018275886      3 2.69360254587070e+01
 -2.20099999296390e+02   2 2.70860075292970e+01
 -2.13493270999809e+00   2 1.22130001295874e+01
2
  3.21240002430625e+02   2 2.64320193944270e+01
  6.03470084610628e+01   2 1.17489696842121e+01
2
  2.36539998999428e+02   2 2.94929998193907e+01
  4.43969887908906e+01   2 1.15569831458722e+01

Cu GEN 10 2
4
  19.00000000 1 31.53811263 
 599.22413997 3 31.06925531 
-244.68915484 2 30.59035868 
  -1.29349525 2 14.05141063 
2
 370.71371824 2 29.35562242 
  66.27560813 2 12.77235919 
2
 271.66281028 2 33.51694543 
  49.76265057 2 12.52471484 

Zn GEN 10 2
4
   20.00000000 1 35.80797616
  716.15952323 3 34.53646083
 -204.68393323 2 28.62830178
    0.76026614 2  7.96239682
2
  431.70804302 2 35.02141356
   95.87640437 2 14.63498691
2
  313.57770563 2 42.22979234
   74.01270048 2 14.57429304