 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
    20     8     2
Direct
  0.0775138930415835  0.1615274797505606  0.4691498507715792
  0.1623589956224407  0.0766804130912107  0.4691328970584152
  0.0767769946647903  0.4120706866304573  0.4696572656069904
  0.1603494705412629  0.3245070427349503  0.4695741704383920
  0.0901611714576944  0.6609309689378051  0.4696865080080599
  0.0881166013225823  0.9122906213551616  0.4691727707347511
  0.1732499343451295  0.8271595131936351  0.4695803148160493
  0.3253436429025882  0.1595160180145641  0.4695626375027189
  0.4129041366215631  0.0759391762490367  0.4696474938605206
  0.3394780317648340  0.9102516052921175  0.4696791304156562
  0.6617620386960184  0.0893216068761902  0.4696978567921377
  0.5883440740853558  0.9236366029380250  0.4696774160322761
  0.6759067015089784  0.8400660394114112  0.4696092007924193
  0.8279937406604319  0.1724156923799569  0.4696045472209747
  0.9131253415851006  0.0872840646523443  0.4692049701945891
  0.9110912871726029  0.3386482226779677  0.4696917245432815
  0.8408970418647641  0.6750673027221481  0.4695944833979553
  0.9244710861683245  0.5875082911205283  0.4696677020982065
  0.8388839620531812  0.9228985209782934  0.4691729088660992
  0.9237311595162581  0.8380507673323123  0.4691546418514108
  0.4279393586074036  0.8340102781084298  0.4697890416436010
  0.1664001424040791  0.5724675332012481  0.4697828206810755
  0.5958845192564226  0.6783418216251320  0.4700301203482553
  0.3220725397999118  0.4045286994186554  0.4699926228867284
  0.6791769473689939  0.5950469881380940  0.4700377014871506
  0.4053658896170589  0.3212352988911746  0.4700024324389176
  0.8348474443279557  0.4271071078917501  0.4698014341155741
  0.5732978734037530  0.1655621454340448  0.4697881115629912
  0.3803075903731994  0.6201098336374926  0.4701272297557679
  0.6209371005007114  0.3794777969871888  0.4701868630869797
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
