%nprocshared=20
%mem=20GB
#p wb97xd/genecp scrf=(solvent=dichloromethane,pcm) nosymm scf=yqc

min-tsa1_ccpVTZ

1 1
 C	-0.382410000	 2.597684000	 2.722722000
 C	-1.473446000	 2.119776000	 3.476598000
 O	 3.126760000	-0.608871000	-1.357229000
 N	-0.761061000	-1.490200000	 3.028471000
 C	 0.277228000	-1.920420000	 2.262754000
 C	-0.789606000	-0.110815000	 3.038126000
 C	 0.301427000	 0.346511000	 2.267826000
 C	 0.899150000	 0.091255000	-1.407537000
 C	 2.078100000	-0.589477000	-1.975973000
 O	 1.829278000	-1.210674000	-3.118828000
 C	 2.907989000	-1.966196000	-3.719974000
 C	 3.769781000	-1.067409000	-4.583058000
 C	 0.976545000	-0.829811000	 1.759464000
 C	-1.692125000	 0.763403000	 3.649547000
 C	 0.509340000	 1.726132000	 2.121005000
 H	 2.394175000	-2.722527000	-4.312768000
 H	 3.485614000	-2.448199000	-2.927734000
 H	 3.158761000	-0.566870000	-5.340127000
 H	 4.529085000	-1.668147000	-5.092812000
 H	 4.279485000	-0.313590000	-3.975873000
 H	 1.961162000	-0.864831000	 1.307671000
 H	 1.347391000	 2.097623000	 1.538982000
 H	-0.240556000	 3.668613000	 2.615853000
 H	-2.153895000	 2.830542000	 3.934948000
 H	-2.530726000	 0.391254000	 4.228570000
 H	-1.470343000	-2.092455000	 3.427130000
 Cu	-0.050751000	-1.118560000	-0.221843000
 P	-1.206150000	-3.017546000	-0.761641000
 N	-1.878276000	-3.216137000	-2.299747000
 N	-2.611936000	-3.596486000	-0.043515000
 O	-0.159321000	-4.270537000	-0.512549000
 C	-3.057765000	-3.989724000	-2.245911000
 C	-1.278567000	-2.798746000	-3.536234000
 C	-3.480174000	-4.183271000	-0.991461000
 C	-3.052191000	-3.244980000	 1.272186000
 C	 1.238554000	-4.030073000	-0.730532000
 H	-3.512819000	-4.333475000	-3.162701000
 C	-1.504433000	-1.484073000	-3.996460000
 C	-0.514936000	-3.722802000	-4.272238000
 H	-4.361698000	-4.706033000	-0.651339000
 C	-2.800253000	-4.130035000	 2.335239000
 C	-3.744018000	-2.034776000	 1.454825000
 H	 1.581635000	-3.213827000	-0.079397000
 H	 1.399179000	-3.720150000	-1.769494000
 C	 1.990605000	-5.304700000	-0.420198000
 C	-0.925976000	-1.112998000	-5.210173000
 C	-2.382116000	-0.504663000	-3.224632000
 C	 0.025392000	-3.304289000	-5.491480000
 C	-0.321129000	-5.164263000	-3.822720000
 C	-3.250888000	-3.765445000	 3.607809000
 C	-2.115614000	-5.467400000	 2.109189000
 C	-4.166921000	-1.708268000	 2.744907000
 C	-4.028906000	-1.089046000	 0.299850000
 H	 3.062448000	-5.152614000	-0.578925000
 H	 1.827833000	-5.599471000	 0.620761000
 H	 1.652441000	-6.115814000	-1.071331000
 H	-1.071729000	-0.109527000	-5.593634000
 C	-0.168081000	-2.011102000	-5.952424000
 H	-2.110270000	-0.580260000	-2.163898000
 C	-2.190408000	 0.956039000	-3.645772000
 C	-3.871446000	-0.863184000	-3.358913000
 H	 0.604721000	-4.001899000	-6.088885000
 H	-0.575956000	-5.230603000	-2.761446000
 C	 1.125785000	-5.651667000	-3.981340000
 C	-1.269220000	-6.095681000	-4.595103000
 H	-3.081394000	-4.430810000	 4.448798000
 C	-3.924351000	-2.564007000	 3.813368000
 H	-1.634132000	-5.431740000	 1.129340000
 C	-1.026354000	-5.766102000	 3.145653000
 C	-3.162871000	-6.591084000	 2.078158000
 H	-4.693286000	-0.773796000	 2.917019000
 H	-3.689423000	-1.566184000	-0.622779000
 C	-3.248817000	 0.221173000	 0.452784000
 C	-5.531649000	-0.829325000	 0.140371000
 H	 0.264914000	-1.701040000	-6.898871000
 H	-2.702423000	 1.612671000	-2.934896000
 H	-1.136920000	 1.247522000	-3.677729000
 H	-2.625334000	 1.144970000	-4.633951000
 H	-4.173531000	-0.830930000	-4.412082000
 H	-4.481682000	-0.135995000	-2.810919000
 H	-4.099617000	-1.856987000	-2.966945000
 H	 1.415105000	-5.736780000	-5.034461000
 H	 1.231816000	-6.645946000	-3.534685000
 H	 1.841417000	-4.983845000	-3.490892000
 H	-1.042538000	-6.073891000	-5.667528000
 H	-2.315960000	-5.804342000	-4.468021000
 H	-1.158617000	-7.127634000	-4.244649000
 H	-4.263235000	-2.297714000	 4.809856000
 H	-0.501652000	-6.688088000	 2.874287000
 H	-0.285119000	-4.961351000	 3.198185000
 H	-1.439885000	-5.907958000	 4.150309000
 H	-3.680516000	-6.670247000	 3.041448000
 H	-2.683161000	-7.553318000	 1.868918000
 H	-3.915664000	-6.409693000	 1.303904000
 H	-3.568439000	 0.786197000	 1.334892000
 H	-3.385579000	 0.854512000	-0.431141000
 H	-2.175770000	 0.021837000	 0.575313000
 H	-5.949736000	-0.321284000	 1.016340000
 H	-6.075925000	-1.768310000	-0.002298000
 H	-5.713483000	-0.192813000	-0.732020000
 C	 0.691886000	 1.451061000	-1.720992000
 C	 1.451699000	 2.133399000	-2.711943000
 C	-0.340843000	 2.157424000	-1.049939000
 C	 1.174610000	 3.449855000	-3.019455000
 H	 2.240431000	 1.608488000	-3.241997000
 C	-0.600327000	 3.481866000	-1.347237000
 H	-0.922255000	 1.640706000	-0.295536000
 C	 0.152741000	 4.120560000	-2.334765000
 H	 1.744430000	 3.966249000	-3.783663000
 H	-1.386072000	 4.017481000	-0.826530000
 H	-0.057305000	 5.157303000	-2.578757000
 H	 0.493388000	-2.975591000	 2.168120000

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



