GENBAS.txt

!----------------------------------------------------------------------
! Basis Set Exchange
! Version v0.8.10
! https://www.basissetexchange.org
!----------------------------------------------------------------------
!   Basis set: cc-pV(Q+d)Z
! Description: cc-pV(Q+d)Z
!        Role: orbital
!     Version: 1  (Data from ccRepo/Grant Hill)
!----------------------------------------------------------------------



H:cc-pV(Q+d)Z
cc-pV(Q+d)Z

  4
    0    1    2    3
    4    3    2    1
    6    3    2    1

8.264000D+01 1.241000D+01 2.824000D+00 7.977000D-01 2.581000D-01 
8.989000D-02 

2.006000D-03 0.000000D+00 0.000000D+00 0.000000D+00 
1.534300D-02 0.000000D+00 0.000000D+00 0.000000D+00 
7.557900D-02 0.000000D+00 0.000000D+00 0.000000D+00 
2.568750D-01 1.000000D+00 0.000000D+00 0.000000D+00 
4.973680D-01 0.000000D+00 1.000000D+00 0.000000D+00 
2.961330D-01 0.000000D+00 0.000000D+00 1.000000D+00 

2.292000D+00 8.380000D-01 2.920000D-01 

1.000000D+00 0.000000D+00 0.000000D+00 
0.000000D+00 1.000000D+00 0.000000D+00 
0.000000D+00 0.000000D+00 1.000000D+00 

2.062000D+00 6.620000D-01 

1.000000D+00 0.000000D+00 
0.000000D+00 1.000000D+00 

1.397000D+00 

1.0000000 

O:cc-pV(Q+d)Z
cc-pV(Q+d)Z

  5
    0    1    2    3    4
    5    4    3    2    1
   12    6    3    2    1

6.142000D+04 9.199000D+03 2.091000D+03 5.909000D+02 1.923000D+02 
6.932000D+01 2.697000D+01 1.110000D+01 4.682000D+00 1.428000D+00 
5.547000D-01 2.067000D-01 

9.000000D-05 -2.000000D-05 0.000000D+00 0.000000D+00 0.000000D+00 
6.980000D-04 -1.590000D-04 0.000000D+00 0.000000D+00 0.000000D+00 
3.664000D-03 -8.290000D-04 0.000000D+00 0.000000D+00 0.000000D+00 
1.521800D-02 -3.508000D-03 0.000000D+00 0.000000D+00 0.000000D+00 
5.242300D-02 -1.215600D-02 0.000000D+00 0.000000D+00 0.000000D+00 
1.459210D-01 -3.626100D-02 0.000000D+00 0.000000D+00 0.000000D+00 
3.052580D-01 -8.299200D-02 0.000000D+00 0.000000D+00 0.000000D+00 
3.985080D-01 -1.520900D-01 0.000000D+00 0.000000D+00 0.000000D+00 
2.169800D-01 -1.153310D-01 0.000000D+00 0.000000D+00 0.000000D+00 
1.759400D-02 2.889790D-01 1.000000D+00 0.000000D+00 0.000000D+00 
-2.502000D-03 5.861280D-01 0.000000D+00 1.000000D+00 0.000000D+00 
9.540000D-04 2.776240D-01 0.000000D+00 0.000000D+00 1.000000D+00 

6.342000D+01 1.466000D+01 4.459000D+00 1.531000D+00 5.302000D-01 
1.750000D-01 

6.044000D-03 0.000000D+00 0.000000D+00 0.000000D+00 
4.179900D-02 0.000000D+00 0.000000D+00 0.000000D+00 
1.611430D-01 0.000000D+00 0.000000D+00 0.000000D+00 
3.567310D-01 1.000000D+00 0.000000D+00 0.000000D+00 
4.483090D-01 0.000000D+00 1.000000D+00 0.000000D+00 
2.449400D-01 0.000000D+00 0.000000D+00 1.000000D+00 

3.775000D+00 1.300000D+00 4.440000D-01 

1.000000D+00 0.000000D+00 0.000000D+00 
0.000000D+00 1.000000D+00 0.000000D+00 
0.000000D+00 0.000000D+00 1.000000D+00 

2.666000D+00 8.590000D-01 

1.000000D+00 0.000000D+00 
0.000000D+00 1.000000D+00 

1.846000D+00 

1.0000000 

S:cc-pV(Q+d)Z
cc-pV(Q+d)Z

  5
    0    1    2    3    4
    6    5    4    2    1
   16   11    4    2    1

7.278000D+05 1.090000D+05 2.480000D+04 7.014000D+03 2.278000D+03 
8.147000D+02 3.134000D+02 1.277000D+02 5.448000D+01 2.385000D+01 
9.428000D+00 4.290000D+00 1.909000D+00 6.270000D-01 2.873000D-01 
1.172000D-01 

2.360250D-05 -6.521790D-06 1.894060D-06 0.000000D+00 0.000000D+00 0.000000D+00 
1.834820D-04 -5.066310D-05 1.469480D-05 0.000000D+00 0.000000D+00 0.000000D+00 
9.642780D-04 -2.668330D-04 7.754600D-05 0.000000D+00 0.000000D+00 0.000000D+00 
4.065370D-03 -1.126010D-03 3.265090D-04 0.000000D+00 0.000000D+00 0.000000D+00 
1.469730D-02 -4.111860D-03 1.196860D-03 0.000000D+00 0.000000D+00 0.000000D+00 
4.650810D-02 -1.324540D-02 3.847990D-03 0.000000D+00 0.000000D+00 0.000000D+00 
1.255080D-01 -3.770040D-02 1.105390D-02 0.000000D+00 0.000000D+00 0.000000D+00 
2.684330D-01 -8.985540D-02 2.646450D-02 0.000000D+00 0.000000D+00 0.000000D+00 
3.848090D-01 -1.670980D-01 5.087710D-02 0.000000D+00 0.000000D+00 0.000000D+00 
2.653720D-01 -1.693540D-01 5.300300D-02 0.000000D+00 0.000000D+00 0.000000D+00 
4.373260D-02 1.278240D-01 -4.255180D-02 0.000000D+00 0.000000D+00 0.000000D+00 
-3.788070D-03 5.648620D-01 -2.508530D-01 0.000000D+00 0.000000D+00 0.000000D+00 
2.180830D-03 4.317670D-01 -3.331520D-01 0.000000D+00 0.000000D+00 0.000000D+00 
-8.369440D-04 3.893980D-02 2.637960D-01 1.000000D+00 0.000000D+00 0.000000D+00 
4.480880D-04 -7.302600D-03 6.668490D-01 0.000000D+00 1.000000D+00 0.000000D+00 
-1.252930D-04 1.923270D-03 2.884510D-01 0.000000D+00 0.000000D+00 1.000000D+00 

1.546000D+03 3.664000D+02 1.184000D+02 4.453000D+01 1.838000D+01 
7.965000D+00 3.541000D+00 1.591000D+00 6.205000D-01 2.420000D-01 
9.014000D-02 

4.411830D-04 -1.131100D-04 0.000000D+00 0.000000D+00 0.000000D+00 
3.775710D-03 -9.585810D-04 0.000000D+00 0.000000D+00 0.000000D+00 
1.983600D-02 -5.134710D-03 0.000000D+00 0.000000D+00 0.000000D+00 
7.420630D-02 -1.926410D-02 0.000000D+00 0.000000D+00 0.000000D+00 
1.973270D-01 -5.359800D-02 0.000000D+00 0.000000D+00 0.000000D+00 
3.518510D-01 -9.603330D-02 0.000000D+00 0.000000D+00 0.000000D+00 
3.786870D-01 -1.181830D-01 0.000000D+00 0.000000D+00 0.000000D+00 
1.709310D-01 9.231940D-03 0.000000D+00 0.000000D+00 0.000000D+00 
1.515870D-02 3.588410D-01 1.000000D+00 0.000000D+00 0.000000D+00 
6.719810D-05 5.258180D-01 0.000000D+00 1.000000D+00 0.000000D+00 
4.054910D-04 2.488720D-01 0.000000D+00 0.000000D+00 1.000000D+00 

4.159000D+00 1.019000D+00 4.640000D-01 1.940000D-01 

1.000000D+00 0.000000D+00 0.000000D+00 0.000000D+00 
0.000000D+00 1.000000D+00 0.000000D+00 0.000000D+00 
0.000000D+00 0.000000D+00 1.000000D+00 0.000000D+00 
0.000000D+00 0.000000D+00 0.000000D+00 1.000000D+00 

3.350000D-01 8.690000D-01 

1.000000D+00 0.000000D+00 
0.000000D+00 1.000000D+00 

6.830000D-01 

1.0000000