%chk=000257687.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257687

0 1
Cl 5.094343 -0.856991 -1.298820
N -1.305291 1.053237 -0.203737
N -1.444985 -1.134299 0.778990
C -0.127733 1.479728 0.617863
C -0.336263 1.285768 2.134200
C 1.179994 0.856356 0.146619
C -1.459421 1.813951 -1.481867
C -1.917303 -0.209023 -0.128210
C -1.466024 2.155515 2.674529
C 1.539893 -0.457520 0.475669
C 2.054584 1.637787 -0.627945
C -0.761791 1.157404 -2.670562
C -3.070622 -0.497071 -0.921952
C 2.750394 -0.996617 0.029946
C 3.268934 1.115707 -1.079399
C 3.595400 -0.199409 -0.742642
C -3.723409 -1.709807 -0.753687
C -2.112519 -2.306941 0.920113
C -3.251034 -2.642703 0.179591
H -0.057752 2.597562 0.450366
H 0.613696 1.532326 2.649938
H -0.534371 0.220440 2.376904
H -2.549770 1.929140 -1.689616
H -1.065403 2.843259 -1.324122
H -2.415330 1.927967 2.171319
H -1.616223 1.981518 3.746205
H -1.267431 3.223328 2.537084
H 0.866794 -1.072369 1.083177
H 1.791622 2.664097 -0.882759
H 0.313275 1.021445 -2.491134
H -1.168915 0.160011 -2.883496
H -0.872875 1.759218 -3.578723
H -3.444743 0.229836 -1.636484
H 3.026882 -2.019803 0.281676
H 3.947464 1.720650 -1.678629
H -4.608151 -1.938428 -1.349183
H -1.691434 -2.996567 1.661980
H -3.749782 -3.593805 0.321996


%chk=000257687-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257687

0 1
Cl 5.401629 -0.917571 -1.160893
N -1.233472 0.985666 -0.291679
N -1.490216 -1.083538 0.857639
C -0.066470 1.425060 0.550713
C -0.291608 1.335490 2.086069
C 1.276367 0.812644 0.118972
C -1.549559 1.838855 -1.463766
C -1.925587 -0.214622 -0.119365
C -1.574990 2.050539 2.552766
C 1.581373 -0.559067 0.324432
C 2.260249 1.641578 -0.477400
C -0.979571 1.311924 -2.802544
C -3.070257 -0.548648 -0.925472
C 2.829766 -1.090752 -0.065629
C 3.518614 1.129228 -0.870505
C 3.780393 -0.236273 -0.657896
C -3.759111 -1.747040 -0.679070
C -2.180955 -2.236267 1.074855
C -3.322993 -2.623366 0.345641
H 0.006549 2.510041 0.334220
H 0.594175 1.807863 2.556559
H -0.312462 0.280748 2.398204
H -2.645799 1.975333 -1.540410
H -1.134906 2.842234 -1.262865
H -2.474287 1.567530 2.131855
H -1.658902 2.018618 3.654411
H -1.583843 3.114595 2.245001
H 0.821002 -1.202467 0.778566
H 2.051396 2.707423 -0.635694
H 0.121340 1.249274 -2.758360
H -1.366949 0.304523 -3.034270
H -1.258752 1.988381 -3.631918
H -3.418143 0.111216 -1.722878
H 3.059556 -2.148998 0.090596
H 4.273328 1.776070 -1.327008
H -4.633823 -1.999067 -1.289281
H -1.783097 -2.877161 1.871640
H -3.835284 -3.565099 0.559961


