 C  N Fe                                
   1.00000000000000     
     9.8736660799999996    0.0000000000000000    0.0000000000000000
    -4.9368330399999980    8.5508456537647159    0.0000000000000000
     0.0000000000000006    0.0000000000000011   15.6500000000000004
   C    N    Fe
    21     7     2
Direct
  0.0861356613222455  0.1688078395359938  0.4677110165979670
  0.1654493356329212  0.0808391086794558  0.4691388757442638
  0.0821253266534541  0.4142330279239772  0.4687769360214418
  0.1697386283602071  0.3324741592952876  0.4687234470088200
  0.0766665533032409  0.6541475682192512  0.4715406024046658
  0.0775007522488167  0.9122079109991077  0.4706118823128591
  0.1615821456097493  0.8239797931763135  0.4713473765963769
  0.3326006886843587  0.1660330521173350  0.4693160959558682
  0.4146374535711033  0.0809163161639574  0.4691626068087444
  0.4179340604555506  0.3367042140658114  0.4700470202062093
  0.3339323313631226  0.9122735792245606  0.4706066279948260
  0.5819080431756731  0.1688336852402017  0.4676802698461202
  0.6696620284259183  0.0915760121529132  0.4665773973995613
  0.6619542844943638  0.3324998695610688  0.4686261620273484
  0.5883151128729907  0.9302796177645760  0.4691994263684265
  0.6747763680066612  0.8502534667129638  0.4709748142859169
  0.8348541934972786  0.1704948122987062  0.4655354159146725
  0.9211059400713637  0.0915349410326129  0.4665190938508630
  0.8313356813617503  0.4142322605055924  0.4687225960318386
  0.9160259091440395  0.3328027471662693  0.4668625514303884
  0.8412322903586045  0.9302481952676303  0.4691614042588910
  0.3333571742720025  0.4156601366970207  0.4705644828802988
  0.5814867381144992  0.4156359525360713  0.4706153680835286
  0.1605362566684789  0.5744910666453293  0.4712570746338827
  0.9131473649998796  0.5744735343247385  0.4713712473956306
  0.4267853011989331  0.8420127978374836  0.4714636840412609
  0.5966092364072182  0.6939984907723655  0.4750603217240297
  0.9144265201142900  0.8419400113979805  0.4715137490796835
  0.3821982081085835  0.6308282357651365  0.4735959339067435
  0.7478727552429874  0.6308184721228685  0.4735631645562108
 
  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
