 C  N Ir Ru                             
   1.00000000000000     
     9.8736660799999996    0.0000000000000000    0.0000000000000000
    -4.9368330399999980    8.5508456537647159    0.0000000000000000
     0.0000000000000006    0.0000000000000011   15.6500000000000004
   C    N    Ir   Ru
    21     7     1     1
Direct
  0.0856920793841647  0.1673801032115775  0.4579493655195459
  0.1653933486390748  0.0797736530645169  0.4636233556851662
  0.0787954465195315  0.4110390764600588  0.4646120659221282
  0.1677078209569128  0.3292719078941271  0.4654246323808679
  0.0753611565398207  0.6516478181243202  0.4776204699706028
  0.0788995904644426  0.9126840392537691  0.4715377666830720
  0.1615167872874053  0.8235666500213653  0.4754458576991978
  0.3314345241018578  0.1646340631765288  0.4650477221514263
  0.4140496226570634  0.0810191162743018  0.4633648235863277
  0.4153911659911428  0.3331749130643444  0.4724926453150728
  0.3341258772554564  0.9138616860802147  0.4699784281595991
  0.5809500555344006  0.1692729538328006  0.4569555229536296
  0.6695273499937558  0.0931640483947004  0.4504185739822217
  0.6602892995748950  0.3319485931892645  0.4649831959116658
  0.5899537084605929  0.9337794020975805  0.4621281269046759
  0.6785038406948414  0.8565990633560752  0.4699939274001568
  0.8346569322094537  0.1704347185714879  0.4464219545767477
  0.9216150255862701  0.0918863736195275  0.4505764862272454
  0.8303714994161406  0.4129062972579062  0.4647903326939123
  0.9148451893939794  0.3321350694342267  0.4542018517300314
  0.8427302690586219  0.9323037282851726  0.4636467009325952
  0.3298665750846604  0.4103741154604188  0.4770361532385189
  0.5788872261407013  0.4118105628716485  0.4791234239411779
  0.1549244319243868  0.5695523748823855  0.4759625974375414
  0.9128589771628588  0.5701565593342321  0.4797428580094678
  0.4299168613886215  0.8482006829644493  0.4738463297197488
  0.6011476358467788  0.7026268203196123  0.4898257692228805
  0.9168553878811709  0.8467721008906178  0.4787991975351681
  0.3815841520523116  0.6313180685022579  0.4846116368072869
  0.7479125561718162  0.6319363153131045  0.5065155439961888
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
