%nprocshared=12
%mem=20GB
#p genecp scf=xqc scrf=(solvent=tetrahydrofuran,smd) nosymm guess=always Int=grid=UltraFine empiricaldispersion=gd3 b3lyp

HFIP_SP

0 1
 C	-0.367416000	 0.306342000	-0.044297000
 C	-1.698476000	-0.456717000	-0.032341000
 F	-1.817761000	-1.184703000	 1.101742000
 F	-1.821216000	-1.291045000	-1.079196000
 F	-2.723834000	 0.411697000	-0.067737000
 C	 0.847973000	-0.629430000	-0.074799000
 O	-0.289829000	 1.164646000	 1.060060000
 H	-0.342413000	 0.913507000	-0.951919000
 F	 0.919489000	-1.351585000	 1.066995000
 F	 1.978077000	 0.091989000	-0.170584000
 F	 0.810654000	-1.487559000	-1.109021000
 H	-0.314069000	 0.619000000	 1.868599000

-C -H -F 0
cc-pvtz
****
-O -N -S 0
aug-cc-pvtz
****
-Cu     0
S   1   1.00
8.1760000              1.0000000
S   1   1.00
2.5680000              1.0000000
S   1   1.00
0.9587000              1.0000000
S   1   1.00
0.1153000              1.0000000
S   1   1.00
0.0396000              1.0000000
P   1   1.00
25.6300000              1.0000000
P   1   1.00
3.1660000              1.0000000
P   1   1.00
1.0230000              1.0000000
P   1   1.00
0.0860000              1.0000000
P   1   1.00
0.0240000              1.0000000
D   3   1.00
41.3400000              0.0465424
11.4200000              0.2227824
3.8390000              0.4539059
D   1   1.00
1.2300000              1.0000000
D   1   1.00
0.3102000              1.0000000
D   1   1.00
0.1010000              1.0000000
****

-CU     0
CU-ECP     2     10
d potential
3
1    511.9951763            -10.0000000
2     93.2801074            -72.5548282
2     23.2206669            -12.7450231
s-d potential
4
0    173.1180854              3.0000000
1    185.2419886             23.8351825
2     73.1517847            473.8930488
2     14.6884157            157.6345823
p-d potential
4
0    100.7191369              5.0000000
1    130.8345665              6.4990936
2     53.8683720            351.4605395
2     14.0989469             85.5016036

