%chk=000215389.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215389

0 1
Cl -7.877804 -1.051202 0.249888
O 1.612740 2.068398 -0.485292
O -1.404759 -1.301331 0.345791
O -2.979336 2.967354 -0.671974
N 0.097580 0.413469 -0.095631
N -2.250403 0.822135 -0.175459
N -0.682913 2.674457 -0.609742
C 1.404921 -0.186250 0.003184
C 2.302286 0.823108 -0.220899
C 0.272785 1.795264 -0.412455
C 1.646348 -1.605708 0.254170
C -1.233116 -0.146714 0.052051
C 3.746240 0.961393 -0.251898
C -3.629332 0.352349 -0.068702
C -2.027978 2.255875 -0.512785
C 1.057069 -2.258906 1.347781
C 2.500275 -2.312285 -0.612448
C 4.336027 1.991194 -1.007568
C 4.554366 0.072914 0.479697
C -4.525955 1.052092 0.756509
C -4.038544 -0.777204 -0.797459
C 1.330707 -3.610215 1.577300
C 2.765181 -3.661842 -0.375688
C 5.725483 2.121854 -1.035040
C 5.943158 0.211790 0.441858
C 2.183248 -4.311236 0.719366
C 6.529778 1.232832 -0.313695
C -5.848950 0.616678 0.850827
C -5.360266 -1.214296 -0.695183
C -6.245391 -0.510773 0.126404
H 0.370811 -1.721081 2.004027
H 2.950193 -1.808076 -1.468072
H 3.704173 2.686333 -1.564646
H 4.100067 -0.719706 1.076138
H -4.201961 1.941092 1.301336
H -3.331327 -1.320474 -1.425966
H 0.868897 -4.118190 2.423934
H 3.422946 -4.211597 -1.048119
H 6.183100 2.919940 -1.619782
H 6.571153 -0.476962 1.006760
H 2.390775 -5.365777 0.899547
H 7.614264 1.337449 -0.338402
H -6.561834 1.151576 1.480136
H -5.695705 -2.091720 -1.249700


%chk=000215389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215389

0 1
Cl -7.977447 -1.119092 0.210197
O 1.585759 2.054485 -0.585342
O -1.411030 -1.320238 0.328895
O -3.023466 3.001852 -0.732219
N 0.087833 0.448410 -0.102620
N -2.241683 0.831086 -0.216623
N -0.702546 2.673792 -0.702683
C 1.385268 -0.165000 0.011525
C 2.297966 0.837145 -0.271174
C 0.229373 1.789413 -0.475919
C 1.626158 -1.595803 0.306080
C -1.221525 -0.121589 0.027021
C 3.756224 0.954055 -0.281307
C -3.616571 0.359127 -0.111416
C -2.035491 2.256478 -0.569197
C 1.199697 -2.187570 1.523559
C 2.326267 -2.386766 -0.643422
C 4.358002 2.082344 -0.908944
C 4.589307 -0.016520 0.345002
C -4.492797 0.963224 0.816287
C -4.063168 -0.690083 -0.944185
C 1.475199 -3.544975 1.787388
C 2.599098 -3.745661 -0.377171
C 5.759826 2.226339 -0.920711
C 5.989605 0.136476 0.327302
C 2.175355 -4.328196 0.839621
C 6.583093 1.254034 -0.306746
C -5.827252 0.516311 0.915945
C -5.394011 -1.148088 -0.847073
C -6.255457 -0.535174 0.082883
H 0.646433 -1.591221 2.255505
H 2.649831 -1.935820 -1.588023
H 3.722010 2.839229 -1.377185
H 4.146072 -0.879357 0.849458
H -4.146616 1.789281 1.442862
H -3.378053 -1.158566 -1.656276
H 1.138054 -3.992638 2.728097
H 3.134099 -4.347668 -1.119406
H 6.209110 3.098415 -1.407520
H 6.619169 -0.614847 0.815980
H 2.383117 -5.383937 1.045536
H 7.672449 1.367755 -0.316387
H -6.517497 0.980016 1.625751
H -5.750767 -1.962455 -1.483243


