unknown system                          
   1.00000000000000     
     7.9487550000000002   -0.0000500000000000    4.9014329999999999
    -3.9745640000000000    6.8838939999999997    4.9012549999999999
    -3.9744389999999998   -6.8837770000000003    4.9012460000000004
  Al              C               H               O               Si            
     1     2     3    25    11
Direct
  0.6366710056782580  0.3575002411040286  0.3458909753653478
  0.8173956522810857  0.9551871713018927  0.4843013439599148
  0.4755060720778150  0.0798901230942516  0.4379959856401781
  0.4996469278258205 -0.0343690661617728  0.3960307599972531
  0.5429927094593108  0.1239115898396603  0.5339823144519240
  0.3687461951002642  1.0939905362018523  0.4545692384415515
  0.2646915405137180  0.7267385222723793  0.0142704477826198
  0.2139530463690606  0.4501589451119776  0.9542549145115904
  0.2952600695783226  0.6030236826411630  0.7478355375247145
  0.5458923565387258  0.7728486993185231  0.7181932094249233
  0.0339505657033159  0.3311427944728714  0.1280059433582313
  0.3737285846691271  0.6559700740315549  0.4961059740155194
  0.2396995637313601  0.5199486849946622  0.2577656840927897
  0.4219081685174375  0.7503192065035281  0.2658908639545051
  0.5045153477883058  0.4817879118211648  0.6720566380177940
  0.7780074827279696  0.7660484921798010  0.8834591048501312
  0.7812059746819262  0.9250336354366089  0.3656600209397603
  0.5911184485034404  0.2483163543008078  0.7609681887017173
  0.5462377758948818  0.8205581677969230  0.0258788032338357
  0.2895815556413943  0.2590743021502470  0.1382542990124839
  0.7927107317354405  0.4869107266565526  0.7737061192244515
  0.5167576584408116  0.4890234641535918  0.3020851408781035
  0.7964792617257244  0.2690802695369572  0.9707875080773440
  0.6987822847010250  0.3708786093851820  0.5266793414758854
  0.5274382947143632  0.1777613856783173  0.3145790966123824
  0.6683267917087194  1.0169100711795762  0.8744251261916383
  0.0293377784421034  0.6441589282748974  0.8453121027957307
  0.3532690668697576  0.9832391362735206  0.1399714459527040
  0.5283346545719980  0.1851292526808838  1.0286197805421471
  0.7800744535828443  0.3771211073353855  0.2376263945455061
  0.8773273889843050  0.5427890597954016  0.0412527079502247
  0.1969071552088217  0.6131850640270492  0.8821926071949013
  0.4282896682290643  0.6373365159302405  0.6602676911647049
  0.6265129384490049  0.8441323216564037  0.8762594043660638
  0.4004938430120198  0.8144699928862003  0.1101475358678009
  0.3992224595321830  0.5959148265885974  0.3316070138862332
  0.1920165593368430  0.4009000707094576  0.1139457657445882
  0.6439686556978549  0.3978496667323787  0.6831183492773257
  0.8648070854182937  0.6189265597912477  0.8887914664612071
  0.6479737038389504  0.1845324695495489  0.9078689408198608
  0.4142682109384735  0.1543320394591904  0.1504627431286118
  0.8717219383789599  0.3866746173708874  0.1040344133021838
 
  0.70792825E-02  0.54753117E-03 -0.11357696E-02
  0.33694729E-02  0.43810295E-03  0.63743297E-02
  0.85139385E-02 -0.11415442E-02  0.10468952E-01
  0.21198025E-01  0.11142916E-02 -0.11367934E-01
  0.34176639E-02 -0.64678926E-03 -0.34448674E-03
 -0.30350117E-03 -0.24642738E-01 -0.33467231E-02
 -0.14678853E-02  0.31355273E-02 -0.78608042E-03
  0.66351726E-02 -0.26849601E-03  0.12765785E-02
  0.57592488E-02  0.32615460E-02 -0.79824180E-02
 -0.10364105E-01 -0.92901089E-03 -0.55099770E-02
 -0.71652270E-02 -0.86798264E-02  0.35466090E-02
  0.21091542E-02 -0.23376160E-02  0.19549631E-02
  0.61102002E-02  0.87693121E-02  0.34395349E-02
  0.72036269E-03 -0.37102329E-02 -0.35446811E-02
 -0.39358626E-02  0.30341611E-02 -0.12236573E-02
 -0.10256694E-02 -0.34589529E-03  0.77453982E-03
 -0.38716373E-02  0.97729413E-03  0.35317576E-02
 -0.39787990E-02 -0.24533000E-02 -0.67587738E-02
 -0.60357908E-02  0.25968855E-02 -0.10781359E-03
  0.19860069E-02  0.24455232E-02 -0.31758557E-02
  0.24722391E-02  0.37379293E-02 -0.53749553E-02
 -0.35346504E-02 -0.20994915E-02  0.90260001E-03
 -0.36015030E-03  0.36200615E-03  0.74653098E-02
 -0.79502739E-02  0.50932861E-02 -0.57287860E-03
  0.44446936E-03 -0.47098969E-02  0.32046625E-02
 -0.15654844E-02 -0.42500033E-02  0.20357715E-02
 -0.20709800E-02 -0.49985036E-02 -0.64664140E-02
  0.41281899E-02 -0.32943820E-04  0.40334850E-02
  0.22902649E-02 -0.10948706E-02 -0.36757599E-02
  0.29161759E-02 -0.36633189E-02  0.66781370E-02
  0.38161716E-02  0.13848359E-02  0.11999882E-01
 -0.37341170E-02  0.73305744E-03  0.89287995E-03
  0.19713816E-02  0.63184065E-02 -0.60946991E-03
  0.25941157E-02 -0.51796938E-03  0.75884379E-02
 -0.21607696E-02 -0.24643740E-02  0.32870269E-02
 -0.39747981E-02 -0.73861559E-03 -0.66427316E-03
 -0.37851091E-02  0.20531211E-03 -0.26410468E-02
  0.29200055E-03  0.26143337E-02 -0.68888720E-02
  0.39438676E-02  0.12412414E-02 -0.14233523E-02
  0.32697889E-02 -0.33195708E-02  0.30094328E-02
 -0.13942908E-02  0.22920542E-02 -0.50161390E-02
 -0.35612397E-02 -0.12863116E-02 -0.52653021E-02
 
           1
   1.00000000000000     
  0.10000000E+01  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.63718749E+00  0.35716590E+00  0.34547708E+00
  0.81811177E+00  0.95551120E+00  0.48456173E+00
  0.47693212E+00  0.80162147E-01  0.43843383E+00
  0.50065164E+00  0.96404981E+00  0.39428773E+00
  0.54325592E+00  0.12369786E+00  0.53386254E+00
  0.36849311E+00  0.91985771E-01  0.45614427E+00
  0.26451497E+00  0.72697436E+00  0.14050799E-01
  0.21459635E+00  0.44994801E+00  0.95408298E+00
  0.29520020E+00  0.60247620E+00  0.74681424E+00
  0.54464840E+00  0.77284112E+00  0.71832060E+00
  0.33590828E-01  0.33105402E+00  0.12917808E+00
  0.37403843E+00  0.65584479E+00  0.49632027E+00
  0.24044595E+00  0.52056331E+00  0.25710641E+00
  0.42172751E+00  0.74977844E+00  0.26588908E+00
  0.50410203E+00  0.48209013E+00  0.67191809E+00
  0.77797414E+00  0.76611906E+00  0.88357992E+00
  0.78112146E+00  0.92550717E+00  0.36599159E+00
  0.59032508E+00  0.24784536E+00  0.76085358E+00
  0.54572423E+00  0.82099257E+00  0.25935968E-01
  0.28953213E+00  0.25895266E+00  0.13777740E+00
  0.79255252E+00  0.48671301E+00  0.77296540E+00
  0.51652260E+00  0.48908058E+00  0.30244725E+00
  0.79695678E+00  0.26962937E+00  0.97128402E+00
  0.69807655E+00  0.37154299E+00  0.52660384E+00
  0.52769352E+00  0.17761859E+00  0.31512050E+00
  0.66833395E+00  0.16805476E-01  0.87493792E+00
  0.28724301E-01  0.64344295E+00  0.84532224E+00
  0.35388961E+00  0.98333794E+00  0.14007503E+00
  0.52827675E+00  0.18470370E+00  0.28353277E-01
  0.78077321E+00  0.37718690E+00  0.23822435E+00
  0.87846356E+00  0.54354570E+00  0.41808180E-01
  0.19665471E+00  0.61345562E+00  0.88235668E+00
  0.42841356E+00  0.63767132E+00  0.65968464E+00
  0.62724660E+00  0.84450199E+00  0.87670432E+00
  0.40053617E+00  0.81460515E+00  0.11064070E+00
  0.39884392E+00  0.59598269E+00  0.33178218E+00
  0.19151949E+00  0.40089410E+00  0.11390997E+00
  0.64352463E+00  0.39755881E+00  0.68244771E+00
  0.86504105E+00  0.61875453E+00  0.88843912E+00
  0.64845261E+00  0.18435890E+00  0.90817760E+00
  0.41381013E+00  0.15421585E+00  0.15001359E+00
  0.87106517E+00  0.38637245E+00  0.10391910E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
