Na\(2)                                  
1.0
       23.1145992279         0.0000000000         0.0000000000
      -11.5572996140        20.0178301297         0.0000000000
        0.0000000000         0.0000000000        10.0000000000
    N    C    H   Ca
    3   39   21    1
Direct
     0.304601848         0.708397448         0.496709943
     0.293154955         0.598047376         0.501460552
     0.403593481         0.696861386         0.500805318
     0.266593933         0.639604330         0.495271593
     0.389871866         0.585928977         0.502450287
     0.457188219         0.608021259         0.502217531
     0.486827612         0.566394627         0.502367437
     0.557385683         0.596428275         0.501920462
     0.588432670         0.558547497         0.500871241
     0.550063670         0.487997919         0.500196815
     0.479391634         0.457361609         0.500326216
     0.448826164         0.495524883         0.501573324
     0.581099272         0.448964059         0.499639452
     0.607233584         0.414264113         0.498942971
     0.636913002         0.373650223         0.497769266
     0.706944764         0.403090864         0.497738749
     0.362047493         0.628715634         0.498443633
     0.415154099         0.805543423         0.499572903
     0.392460406         0.850275815         0.499256313
     0.433513612         0.921374798         0.500239968
     0.402988851         0.961378098         0.500225484
     0.440655738         0.030207954         0.500296772
     0.511242867         0.062245406         0.500339448
     0.542285979         0.022612561         0.500335634
     0.504319489         0.954024017         0.500294447
     0.550566256         0.132170305         0.499968052
     0.585612595         0.192938641         0.499174505
     0.626226604         0.263086349         0.498067051
     0.596707821         0.303587019         0.497627109
     0.372886628         0.734979331         0.495329529
     0.195860416         0.611136019         0.498415828
     0.151237056         0.543622673         0.500703275
     0.079886571         0.513210416         0.501388192
     0.039755438         0.442609280         0.501930058
     0.970709145         0.411083370         0.500923514
     0.938074648         0.449080408         0.500169635
     0.977683425         0.519736528         0.500181317
     0.046399031         0.550667882         0.500627577
     0.867981791         0.418152124         0.499632478
     0.807167888         0.392441899         0.499047965
     0.736915708         0.362930685         0.498091668
     0.696300626         0.292909324         0.498105645
     0.352890283         0.532733202         0.503064692
     0.491117567         0.662034631         0.500248194
     0.587471008         0.650877178         0.501957238
     0.642761290         0.582458913         0.500405371
     0.449633986         0.402976125         0.499588698
     0.394398987         0.470425665         0.501322806
     0.738123834         0.457262933         0.497980893
     0.468388349         0.822123349         0.500865102
     0.338391662         0.829645872         0.496907800
     0.348537147         0.936602950         0.499878377
     0.416722924         0.060599662         0.500169098
     0.596678138         0.047607064         0.500167489
     0.529291987         0.924623966         0.499694854
     0.542526364         0.280554950         0.497517437
     0.178860903         0.647467494         0.496602476
     0.171907336         0.510173857         0.500564635
     0.064356834         0.412736148         0.502111733
     0.940657854         0.356701821         0.500663817
     0.952681541         0.549141347         0.499786288
     0.075344644         0.605060458         0.500102401
     0.719184518         0.261645019         0.498838693
     0.332510471         0.669912577         0.608122766
