%chk=000246729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246729

0 1
Cl 6.874584 1.031047 -0.533998
O -1.676696 1.883060 -1.151448
N 0.278835 0.185504 -0.165773
N -1.061816 -0.067103 -0.026970
N -6.059831 -0.417850 -0.050968
C 1.180399 -0.586176 0.377766
C 0.950323 -1.820811 1.219631
C 2.591462 -0.179630 0.140475
C 3.542430 -1.141514 -0.240160
C 2.973869 1.164145 0.293574
C 0.562922 -3.025702 0.367486
C 4.871617 -0.770266 -0.451951
C 4.301695 1.545132 0.085439
C 5.230472 0.569224 -0.281135
C -3.400548 0.389757 -0.388804
C -1.981050 0.860893 -0.593300
C -4.093306 0.739425 0.773590
C -4.033765 -0.359318 -1.384405
C -5.427626 0.314862 0.901379
C -5.370256 -0.742482 -1.174655
H 1.864430 -2.054894 1.807652
H 0.173942 -1.619215 1.986688
H 3.244531 -2.180835 -0.379472
H 2.226945 1.915279 0.562456
H -0.356599 -2.857459 -0.203961
H 1.347275 -3.270632 -0.361486
H 0.407510 -3.915918 0.989563
H 5.614744 -1.509781 -0.748757
H 4.604553 2.585965 0.201328
H -1.405172 -0.910013 0.448167
H -3.622495 1.335972 1.553273
H -3.515327 -0.627647 -2.303887
H -6.020564 0.564495 1.790343
H -5.917887 -1.327514 -1.924381


%chk=000246729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246729

0 1
Cl 7.022540 1.041587 -0.626371
O -1.723504 1.664177 -1.496861
N 0.289407 0.217969 -0.192549
N -1.054262 -0.068040 -0.050770
N -6.193947 -0.297988 0.028329
C 1.186347 -0.557422 0.403238
C 0.842531 -1.786029 1.239771
C 2.607228 -0.182729 0.166441
C 3.683692 -0.968439 0.663745
C 2.919056 0.987698 -0.588031
C 0.751006 -3.079260 0.380896
C 5.026943 -0.603705 0.425228
C 4.251759 1.364526 -0.830273
C 5.292367 0.560573 -0.317616
C -3.441283 0.335747 -0.411014
C -2.012325 0.726595 -0.707961
C -3.866009 -0.287203 0.791488
C -4.428002 0.654560 -1.376790
C -5.238710 -0.579738 0.962523
C -5.773717 0.316643 -1.120443
H 1.598113 -1.921440 2.032044
H -0.112340 -1.633731 1.783534
H 3.495233 -1.879816 1.239839
H 2.093169 1.589294 -0.977997
H -0.013532 -2.987251 -0.411487
H 1.714572 -3.290201 -0.114670
H 0.490875 -3.948280 1.011169
H 5.848074 -1.214851 0.810393
H 4.480845 2.265780 -1.406069
H -1.378162 -0.887349 0.479974
H -3.170671 -0.506549 1.609975
H -4.132046 1.163854 -2.298555
H -5.598436 -1.051043 1.884099
H -6.557213 0.542059 -1.851930


