%nprocshared=24
%mem=110GB
#p wb97xd/genecp scrf=(solvent=dichloromethane,pcm)
nosymm scf=yqc

pre1-catalyst minimum 

1 1
 N                  1.16121600    0.05942100    0.83486300
 N                 -1.23313400    0.15948600    0.82168500
 C                  0.62575000    0.05616500    2.14203100
 C                 -0.71174600    0.10494800    2.13417400
 H                  1.29391500    0.02486400    2.98954300
 H                 -1.39364100    0.12456900    2.97117800
 C                  2.54348400   -0.17463700    0.53485300
 C                  2.96606400   -1.48879900    0.26662500
 C                  3.43578400    0.91290500    0.52085500
 C                  4.31405400   -1.69832400   -0.02869400
 C                  2.00785300   -2.66789500    0.28730500
 C                  4.77656200    0.65026400    0.23418500
 C                  2.98420300    2.32533300    0.85783200
 H                  4.66685200   -2.70327100   -0.24285800
 C                  5.21293400   -0.63981300   -0.04268200
 H                  1.01959600   -2.29553100    0.57050400
 C                  1.89238500   -3.31901400   -1.09786300
 C                  2.40423500   -3.70628500    1.34438000
 H                  5.49325100    1.46557600    0.22804300
 H                  1.89567500    2.36501600    0.76351400
 C                  3.56384300    3.37680300   -0.09643500
 C                  3.33850200    2.66286100    2.31420000
 H                  6.25971900   -0.82084900   -0.26681600
 H                  1.13256400   -4.10613900   -1.10101900
 H                  1.63553400   -2.58041400   -1.88110000
 H                  2.84139700   -3.76149300   -1.41867700
 H                  3.37874700   -4.15446500    1.12192600
 H                  1.66242500   -4.51137000    1.37969100
 H                  2.45905600   -3.24559700    2.33547100
 H                  4.64609500    3.49165300    0.02830600
 H                  3.10844100    4.35184400    0.10675100
 H                  3.37139100    3.12111900   -1.14403800
 H                  4.42380100    2.63353600    2.46603000
 H                  2.88063900    1.95387100    3.01147800
 H                  2.98516900    3.66777200    2.56942000
 C                 -2.61193600   -0.07458100    0.50591800
 C                 -3.48482100    1.02113500    0.40969300
 C                 -3.04705100   -1.39723800    0.30421500
 C                 -4.81987800    0.76407100    0.09019300
 C                 -3.02058800    2.44823500    0.64543100
 C                 -4.38939400   -1.60313200   -0.01632700
 C                 -2.10943000   -2.58667100    0.42924300
 H                 -5.51834500    1.59208300    0.00860100
 C                 -5.26923800   -0.53262400   -0.12463500
 H                 -1.95355600    2.42351600    0.87770400
 C                 -3.19059900    3.29982800   -0.61904600
 C                 -3.74266400    3.07392600    1.84614900
 H                 -4.75399400   -2.61374400   -0.17834100
 H                 -1.11715800   -2.21205900    0.69571800
 C                 -1.98328300   -3.34879700   -0.89644800
 C                 -2.54228400   -3.52809600    1.56060500
 H                 -6.31100600   -0.71121200   -0.37299400
 H                 -2.78461700    4.30421400   -0.45575100
 H                 -2.65983100    2.84971800   -1.46453100
 H                 -4.24613300    3.40495400   -0.89524700
 H                 -4.82157500    3.15365900    1.67008500
 H                 -3.35846400    4.08238300    2.03391100
 H                 -3.59043400    2.47554000    2.75073700
 H                 -2.93744100   -3.78734700   -1.20649600
 H                 -1.24877500   -4.15554500   -0.81252800
 H                 -1.67361400   -2.68473800   -1.72457000
 H                 -3.52448100   -3.96983700    1.35976200
 H                 -2.59938700   -2.98822100    2.51087900
 H                 -1.82040400   -4.34433300    1.67142300
 P                 -0.02594800    0.30893900   -0.32377000
 O                 -0.03803900    1.87059900   -0.77207900
 C                  0.49217200    2.25253700   -2.05938400
 H                 -0.10775500    1.77723700   -2.84500600
 H                  1.52552800    1.89834600   -2.14470400
 C                  0.42597800    3.76014500   -2.15798800
 H                  0.82777800    4.08269200   -3.12305900
 H                 -0.60754200    4.10698100   -2.07492200
 H                  1.01692100    4.22228300   -1.36232700
 Cu                -0.02463100   -1.14560100   -2.01463500

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




