%chk=000289066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289066

0 1
Cl 4.610427 3.263721 1.076753
O -0.266609 -1.374890 2.095149
O -1.347228 -1.946425 -2.381685
N -2.757092 0.092288 -0.026932
N -1.186121 -1.725630 -0.022417
N 0.717131 -1.752279 -1.297924
C 1.219019 -1.618935 0.100618
C -3.507756 0.361339 -1.293035
C -3.261285 0.880113 1.139738
C -2.609374 -1.352543 0.259653
C -3.440993 1.860000 -1.627124
C -3.192127 2.382336 0.817644
C -3.966470 2.711350 -0.464643
C -0.129829 -1.519876 0.907939
C -0.689271 -1.812513 -1.377035
C 2.052262 -0.366061 0.309363
C 1.985672 -2.866983 0.533632
C 2.308826 0.054162 1.627112
C 2.585689 0.358239 -0.764985
C 3.098727 1.177373 1.872322
C 3.379847 1.486388 -0.532899
C 3.626921 1.876273 0.783431
H -4.567229 0.032315 -1.234502
H -3.020022 -0.227606 -2.107249
H -2.606016 0.656623 2.012156
H -4.299570 0.601181 1.421049
H -2.800286 -1.606895 1.331080
H -3.243511 -2.008343 -0.386278
H -4.018085 2.059583 -2.548199
H -2.391083 2.139854 -1.848801
H -2.131128 2.682826 0.698355
H -3.587460 2.962492 1.670914
H -3.865363 3.786057 -0.704326
H -5.047450 2.529618 -0.315988
H 1.327393 -2.008550 -2.059907
H 2.194953 -2.849617 1.613592
H 1.427185 -3.789399 0.326970
H 2.953276 -2.943514 0.021005
H 1.870563 -0.491488 2.470077
H 2.382984 0.064014 -1.795033
H 3.296231 1.505749 2.892878
H 3.794251 2.051953 -1.367368


%chk=000289066-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289066

0 1
Cl 4.772066 3.373120 0.879989
O -0.350218 -1.192524 2.065077
O -1.144226 -2.065568 -2.492104
N -2.925426 0.076447 -0.115577
N -1.097487 -1.568411 -0.151721
N 0.859172 -1.928233 -1.211287
C 1.260068 -1.669176 0.184394
C -3.607706 0.463982 -1.370212
C -3.399946 0.781883 1.095288
C -2.560550 -1.317664 0.029537
C -3.501648 1.986698 -1.598485
C -3.290517 2.310384 0.911123
C -4.029170 2.764035 -0.369778
C -0.140714 -1.435680 0.850604
C -0.512455 -1.875794 -1.423858
C 2.129607 -0.406160 0.339386
C 1.932943 -2.913840 0.823266
C 2.562425 -0.006707 1.630885
C 2.495186 0.382404 -0.777954
C 3.362132 1.142566 1.802576
C 3.301707 1.533060 -0.623516
C 3.727933 1.892342 0.667611
H -4.691066 0.178199 -1.344735
H -3.137792 -0.083867 -2.206686
H -2.783457 0.456929 1.952600
H -4.466412 0.523473 1.323165
H -2.800263 -1.691705 1.041427
H -3.056940 -1.955696 -0.725645
H -4.068298 2.261914 -2.508880
H -2.439067 2.246485 -1.770479
H -2.219974 2.582741 0.836665
H -3.706431 2.818048 1.802769
H -3.906874 3.853332 -0.520189
H -5.117174 2.574178 -0.254052
H 1.495016 -2.246823 -1.940103
H 2.075420 -2.758726 1.904985
H 1.299216 -3.806365 0.680960
H 2.920040 -3.094635 0.362106
H 2.248923 -0.572254 2.513629
H 2.138735 0.113800 -1.777070
H 3.688342 1.451075 2.799847
H 3.584877 2.137033 -1.490454


