 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
    22     6     2
Direct
  0.0868772955818158  0.1742925173409550  0.4719861121174731
  0.1695293533859293  0.0894869342525783  0.4719748062204200
  0.0825026807259066  0.4157840134466099  0.4720414339600401
  0.0860329331175979  0.6690321373757208  0.4719574846216567
  0.1667130889630846  0.5842349213351711  0.4720390730627610
  0.0854380651029206  0.9193777706086267  0.4719023394017015
  0.1700745909286883  0.8371476911887333  0.4718632423542836
  0.3393828707375938  0.1756537418099841  0.4720155146669595
  0.4230410254451939  0.0894842545501022  0.4719502603939428
  0.3369368930489601  0.9193584039283632  0.4718852784751756
  0.4125326392017003  0.8256824727040569  0.4719728925185901
  0.5905095243491696  0.1742679437469302  0.4719869195117349
  0.6660715331138252  0.0805984645727654  0.4718900359444057
  0.5800058994113689  0.9104949438759136  0.4719468373265728
  0.6636589260913875  0.8243341542050570  0.4719959455608558
  0.8329439450137388  0.1628163687785605  0.4718403966182033
  0.9175769330743457  0.0806095010278846  0.4718591091140108
  0.8363492753146532  0.4157480074027426  0.4720631167739894
  0.9170129570124593  0.3309453147959074  0.4719500340136065
  0.9205586418027267  0.5841948788194499  0.4720579544137287
  0.8335188651886384  0.9104911589362612  0.4719099856421602
  0.9161629309608723  0.8256867876607183  0.4719632554986896
  0.3275732327837397  0.6616727380761515  0.4720425890043862
  0.1659450096512938  0.3383321865102729  0.4720624747628657
  0.5848388018364691  0.6666514485482756  0.4721434089651671
  0.4182084031109929  0.3333124987021637  0.4720910551263034
  0.6754769974587851  0.3382891366439396  0.4720939188101991
  0.8371130323499596  0.6616491076734178  0.4720671889429325
  0.3896514452754922  0.4999758484428916  0.4720615370785863
  0.6134103899409902  0.4999990646739255  0.4721302080442233
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
