Water correlation/composite practical g4-composite                      
SP        RHF                                                         GFHFB2              
Number of atoms                            I                3
Charge                                     I                0
Multiplicity                               I                1
Number of electrons                        I               10
Number of alpha electrons                  I                5
Number of beta electrons                   I                5
Number of basis functions                  I              143
Atomic numbers                             I   N=           3
           8           1           1
Nuclear charges                            R   N=           3
  8.00000000E+00  1.00000000E+00  1.00000000E+00
Current cartesian coordinates              R   N=           9
  0.00000000E+00 -1.98924994E-15 -8.13646284E-03  0.00000000E+00  1.43001231E+00
  1.11471430E+00  0.00000000E+00 -1.43001231E+00  1.11471430E+00
Real atomic weights                        R   N=           3
  1.59949146E+01  1.00782504E+00  1.00782504E+00
SCF Energy                                 R     -7.606667385019998E+01
Total Energy                               R     -7.606667385019998E+01
Cartesian Gradient                         R   N=           9
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
