%chk=000269808.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269808

0 1
Cl 5.136067 0.510647 0.884051
O -2.427895 -1.330349 0.687014
O -2.460963 2.734371 -0.365279
N -3.612971 0.622562 1.078890
N -0.551359 2.432496 -1.546311
C -1.176149 -1.802303 -0.032842
C -0.578163 -0.507215 -0.704596
C -1.553475 0.565838 -0.314268
C 0.849149 -0.241020 -0.288448
C -0.344876 -2.428594 1.066526
C -1.691411 -2.804811 -1.049372
C -2.553377 0.019376 0.472279
C -1.564901 1.952067 -0.710694
C 1.896181 -0.811164 -1.031839
C 1.146989 0.565143 0.821821
C 3.226924 -0.582898 -0.673592
C 2.472717 0.803364 1.190432
C 3.494088 0.222899 0.435193
H -0.606655 -0.628295 -1.818874
H 0.594937 -2.843192 0.681352
H -0.086284 -1.695858 1.844897
H -0.890686 -3.238630 1.568750
H -0.872073 -3.291386 -1.590335
H -2.282912 -3.594072 -0.563910
H -2.354049 -2.332889 -1.787807
H 1.676574 -1.437342 -1.895852
H 0.332917 1.013186 1.397298
H -3.780790 1.616883 0.869887
H -4.329468 0.089692 1.539919
H 4.041184 -1.023617 -1.248064
H 2.706134 1.430870 2.050696
H -0.518603 3.420502 -1.744883
H 0.294596 1.917439 -1.709140


%chk=000269808-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269808

0 1
Cl 5.251893 0.705013 1.135070
O -2.234701 -1.254754 0.980705
O -2.605850 2.678904 -0.541900
N -3.500761 0.732391 1.124690
N -0.685732 2.301971 -1.797475
C -1.182266 -1.836461 0.024246
C -0.524275 -0.561493 -0.673572
C -1.555766 0.520986 -0.377186
C 0.902466 -0.227177 -0.222148
C -0.262580 -2.698197 0.890411
C -1.967766 -2.665163 -1.007897
C -2.462740 0.054057 0.571750
C -1.653267 1.872809 -0.894720
C 2.013765 -0.683186 -0.976289
C 1.150523 0.528011 0.952596
C 3.340746 -0.406551 -0.575479
C 2.467396 0.812815 1.374251
C 3.545486 0.336778 0.602135
H -0.478051 -0.792806 -1.758039
H 0.527788 -3.158903 0.271700
H 0.223629 -2.100621 1.678117
H -0.846567 -3.503466 1.368756
H -1.270594 -3.178476 -1.695472
H -2.582651 -3.427653 -0.499846
H -2.632816 -2.015103 -1.603537
H 1.847146 -1.260600 -1.894874
H 0.302402 0.911504 1.530873
H -3.604437 1.696922 0.760524
H -4.131181 0.294000 1.790500
H 4.192697 -0.757990 -1.164930
H 2.652048 1.396524 2.280942
H -0.749579 3.259331 -2.138617
H 0.144993 1.750286 -2.002387


