%chk=000278794.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278794

0 1
Cl 5.003178 -1.207105 -0.760193
O -3.557567 0.783254 -1.683176
O -1.445979 2.546536 0.044861
O -3.435837 -2.854267 0.023858
N 0.072904 -0.549727 0.515539
N 1.504947 1.342299 0.393913
N 2.170063 -2.290373 -0.273341
N 3.850717 1.092799 -0.168339
C -3.386530 -0.440292 0.372083
C -1.072936 0.292032 0.933890
C -3.130723 0.917842 -0.322537
C -2.249480 -0.586749 1.403529
C -1.602400 1.158256 -0.251265
C -3.367549 -1.590996 -0.650841
C 1.313989 -0.028321 0.264735
C 2.418379 -0.879704 -0.116799
C 3.649626 -0.245828 -0.310793
C 2.755769 1.829307 0.180247
H -4.373322 -0.427301 0.885519
H -0.736198 0.978246 1.758832
H -3.684865 1.755866 0.153606
H -2.585497 -0.261150 2.404630
H -1.975042 -1.656277 1.521726
H -1.100330 0.930525 -1.214543
H -2.408389 -1.649346 -1.198246
H -4.193815 -1.499253 -1.378665
H -0.089515 -1.548124 0.339870
H -3.493573 1.648539 -2.142267
H -0.483628 2.757676 0.157812
H -4.318200 -2.987207 0.420146
H 2.717027 -2.823393 0.404700
H 2.454745 -2.600044 -1.204028
H 2.899831 2.917680 0.294638


%chk=000278794-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000278794

0 1
Cl 5.316605 -1.022078 -0.533069
O -3.932777 1.390389 -1.175172
O -1.099419 2.329600 -0.323127
O -3.836581 -2.803095 -0.409886
N 0.212103 -0.641228 0.510919
N 1.429861 1.338120 -0.007027
N 2.591099 -2.179586 0.348530
N 3.786546 1.242729 -0.520188
C -3.439504 -0.472390 0.386194
C -1.032409 0.087149 0.828759
C -3.115494 0.980434 -0.035365
C -2.186065 -0.894559 1.218549
C -1.605014 0.970210 -0.324665
C -3.659580 -1.399218 -0.831364
C 1.402275 -0.017994 0.194647
C 2.611899 -0.809606 0.096477
C 3.751905 -0.084049 -0.303666
C 2.624785 1.914004 -0.334726
H -4.355178 -0.501615 1.007768
H -0.808252 0.778811 1.665292
H -3.276876 1.671107 0.821613
H -2.384491 -0.840361 2.302699
H -1.942065 -1.950783 0.993509
H -1.412810 0.473907 -1.302916
H -2.770505 -1.425200 -1.483132
H -4.517305 -1.043221 -1.430801
H 0.129743 -1.638360 0.299478
H -3.610833 2.281461 -1.466158
H -0.089774 2.226729 -0.227506
H -4.704356 -2.887212 0.060227
H 1.945998 -2.548298 1.046843
H 3.457766 -2.697497 0.199927
H 2.638505 2.997098 -0.473561


