%nprocshared=24
%mem=120GB
#p 
wb97xd/genecp scrf=(solvent=dichloromethane,pcm) nosymm scf=yqc

ats89 with two water molecules                            

0 1
 C                 -0.71415300    0.16977400    0.36381700
 C                 -4.26097500    0.43612200   -0.44844700
 C                 -2.99487700    0.44880200    0.14647500
 H                 -5.14251600    0.76149400    0.09618000
 C                 -1.24386300    0.66803500    1.52713600
 N                 -2.60386000    0.84109900    1.40430800
 C                  0.72415000   -0.08829600    0.06438600
 C                 -1.83268600    0.02809000   -0.54112200
 C                 -4.34543700   -0.00374900   -1.75990100
 H                 -5.31306900   -0.02614600   -2.25303800
 C                 -1.94921700   -0.40793800   -1.86946900
 C                 -3.19881500   -0.41957400   -2.46697700
 H                 -1.06736400   -0.72801900   -2.41763100
 H                 -3.30186900   -0.75332200   -3.49556600
 O                  1.19101900   -0.92668800    2.59147900
 H                  1.16130700   -0.53038700    1.59112900
 H                  2.07887200   -1.29449300    2.71839500
 H                  0.35522100   -1.84523600    2.43639900
 O                 -0.44804500   -2.60770500    2.04005300
 H                 -0.20018600   -3.50910000    2.29744400
 H                 -0.28661800   -2.53184600    1.00142700
 C                  0.98764500   -1.35980000   -0.51963500
 O                  0.30027800   -2.40243400   -0.33119100
 O                  2.08098400   -1.45523100   -1.29786000
 C                  2.45414100   -2.75853600   -1.75387500
 H                  2.57406800   -3.42654700   -0.89486800
 H                  1.65789400   -3.16537900   -2.38438300
 C                  1.58271000    1.08842600   -0.25587600
 C                  1.01681500    2.32146900   -0.61585400
 C                  2.98419800    1.03347400   -0.15465800
 C                  1.80787500    3.43810100   -0.87504100
 H                 -0.06333600    2.40181600   -0.69569700
 C                  3.77673100    2.14447600   -0.42044200
 H                  3.45740900    0.10009900    0.13495100
 C                  3.19505800    3.35906600   -0.78273200
 H                  1.33351100    4.37509300   -1.15567300
 H                  4.85728500    2.06360500   -0.33304200
 H                  3.81342000    4.22900300   -0.98434200
 H                 -0.74457900    0.92380200    2.45157600
 H                 -3.21414600    1.18179100    2.12912100
 C                  3.74951800   -2.60646600   -2.52502400
 H                  4.07318500   -3.58164800   -2.90170400
 H                  3.61653100   -1.93269800   -3.37667800
 H                  4.53895000   -2.20263800   -1.88366400

-C -N -O -P -H 0 
cc-pVTZ 
****
-Cu 0
cc-pVTZ 
F  1  1.0 
3.525    1.000
****




