 2mocoef
header
                     2
SEWARD INTEGRALS                                                                
mo coefficients generated by scfpq                                              
                     1
                    13                    13
 a  
mocoef
(1p4e20.12)                                                                     
  9.963037338494E-01  2.278048398887E-02 -1.099517515588E-02 -1.028432646032E-03
 -1.109122069520E-03  0.000000000000E+00  0.000000000000E+00  4.037568696090E-12
 -4.401972077931E-12 -1.246096484301E-04  2.979362474727E-03 -1.246096494976E-04
  2.979362469920E-03
 -2.014928587316E-01  4.554613309867E-01  3.582710696196E-01  1.352894798527E-01
  3.922229530673E-02  0.000000000000E+00  0.000000000000E+00  2.250977148695E-11
 -3.421516321562E-11  1.959835376001E-01  2.243432020359E-02  1.959835375875E-01
  2.243432013687E-02
  7.214886291657E-11 -1.758192636885E-10 -2.060543048268E-10  6.298545227419E-10
  3.075368843361E-10  0.000000000000E+00  0.000000000000E+00  5.402410120958E-01
  1.802138483250E-01  2.602550633660E-01  1.128218601466E-01 -2.602550632749E-01
 -1.128218601193E-01
  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00
  0.000000000000E+00  7.142675818542E-01  4.026329821877E-01  0.000000000000E+00
  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00
  0.000000000000E+00
  8.495798422947E-02 -1.512132876610E-01 -4.230594047105E-01  4.749484790490E-01
  4.436709509349E-01  0.000000000000E+00  0.000000000000E+00 -2.886191312231E-10
 -1.834674571230E-10  1.160001916950E-01  1.016860425434E-01  1.160001922026E-01
  1.016860431115E-01
  1.108201792039E-01 -2.141334245538E-01 -2.119999706490E+00 -1.866937292300E-01
 -9.359545625780E-01  0.000000000000E+00  0.000000000000E+00  2.379268281335E-10
  1.213776476085E-09  3.661764387229E-02  1.623104288579E+00  3.661764399727E-02
  1.623104291256E+00
  9.341914752477E-11 -1.238256127406E-10 -1.657535458584E-09 -1.628750595149E-10
 -4.832817669521E-10  0.000000000000E+00  0.000000000000E+00 -3.704641936264E-01
 -1.429661521381E+00  9.859226992601E-02  1.774022933415E+00 -9.859226984012E-02
 -1.774022931046E+00
  8.086146701730E-12 -1.476133852604E-10  3.637855402997E-10  9.665408138275E-11
  1.238712761317E-10  0.000000000000E+00  0.000000000000E+00 -6.998128232753E-01
  1.711232811745E+00 -3.915931678631E-01 -4.371206736824E-01  3.915931680235E-01
  4.371206732176E-01
  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00
  0.000000000000E+00 -9.851238841661E-01  1.148274325802E+00  0.000000000000E+00
  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00
  0.000000000000E+00
 -4.934921810576E-02  3.205315404949E-01  1.660170001008E-01 -9.815599712800E-01
  1.251119803576E+00  0.000000000000E+00  0.000000000000E+00  1.268336410564E-11
  3.637443995779E-10 -1.950841209210E-01 -1.848936685968E-01 -1.950841210369E-01
 -1.848936680085E-01
  3.936767605464E-02  1.482425773343E+00 -3.246431280274E+00 -1.254994403545E-01
 -9.298852007201E-01  0.000000000000E+00  0.000000000000E+00  1.720434015141E-10
 -1.050507723744E-10  5.685190881720E-01  8.786466620067E-01  5.685190884381E-01
  8.786466616388E-01
 -6.909089112780E-11  2.468028735616E-09 -4.669983064086E-09  1.046101107782E-09
 -1.443529578572E-09  0.000000000000E+00  0.000000000000E+00 -9.139710081522E-01
  1.121102163902E+00  8.847670898929E-01 -1.448282081530E+00 -8.847670923071E-01
  1.448282086396E+00
 -4.835457734669E-02  1.352462920114E+00 -2.500555845832E+00  5.827461481384E-01
 -7.558579442300E-01  0.000000000000E+00  0.000000000000E+00  1.433954284110E-09
 -1.754329558254E-09 -7.885634936583E-01  1.384987575825E+00 -7.885634906128E-01
  1.384987571054E+00
orbocc
(1p4e20.12)                                                                     
  2.000000000000E+00  2.000000000000E+00  2.000000000000E+00  1.000000000000E+00
  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00
  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00  0.000000000000E+00
  0.000000000000E+00
energy
(1p4e20.12)                                                                     
 -1.172872179578E+01 -1.288961600288E+00 -9.925376728932E-01 -8.173044352108E-01
 -3.784458634029E-01  3.322158206052E-03  4.163248984424E-02  3.689965134514E-01
  4.112865939404E-01  4.149303708131E-01  6.141734029820E-01  9.072183659167E-01
  9.488867747163E-01
