%chk=000218638.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218638

1 1
Cl 4.536809 -2.290113 -2.125350
O -2.408095 -1.289323 1.838092
N -0.266145 -1.949759 1.354201
N -2.893256 0.081906 -0.429125
N -0.609656 0.650194 -0.186213
C -1.508578 -0.501454 -0.269542
C 0.877430 -1.994643 0.478817
C 1.350257 -0.846223 -0.195092
C 0.681300 0.480188 -0.120751
C -1.459572 -1.295333 1.079238
C 1.534724 1.686176 0.007936
C 1.548820 -3.227492 0.330409
C 2.498551 -0.951066 -1.001695
C -0.187392 -2.709527 2.635039
C -3.679202 -0.307129 -1.498377
C -3.358222 0.993154 0.490475
C 2.680135 -3.321667 -0.472770
C 3.147321 -2.176617 -1.135769
C 2.627407 1.667114 0.893207
C 1.247805 2.844391 -0.732418
C -4.957245 0.219137 -1.650038
C -4.643689 1.532439 0.350678
C -5.451622 1.148583 -0.718292
C 3.427343 2.802148 1.029145
C 2.059631 3.973516 -0.594930
C 3.146840 3.954340 0.284150
H -1.299495 -1.188474 -1.139665
H 1.182453 -4.121275 0.842751
H 2.882991 -0.065529 -1.522956
H 0.821442 -2.624802 3.074237
H -0.913647 -2.300299 3.368422
H -0.434209 -3.774692 2.483324
H -3.269815 -1.035337 -2.215709
H -2.694113 1.273886 1.332166
H 3.202342 -4.277666 -0.589409
H 2.848648 0.772760 1.476738
H 0.395011 2.864239 -1.412088
H -5.576599 -0.096491 -2.500238
H -5.002135 2.254936 1.097180
H -6.461710 1.563171 -0.834480
H 4.274266 2.792500 1.717676
H 1.842762 4.872856 -1.173668
H 3.778413 4.838978 0.391197


%chk=000218638-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218638

1 1
Cl 4.495247 -2.404060 -2.279903
O -2.494229 -1.151110 1.876359
N -0.327678 -1.895001 1.372077
N -2.842577 0.114880 -0.507317
N -0.574898 0.757459 -0.056427
C -1.449682 -0.387018 -0.233718
C 0.788141 -1.970534 0.466047
C 1.329693 -0.813509 -0.189362
C 0.735168 0.550538 -0.043969
C -1.497432 -1.195585 1.106301
C 1.618979 1.737624 0.089096
C 1.423221 -3.229258 0.294474
C 2.470765 -0.971658 -1.025368
C -0.298008 -2.697223 2.627594
C -3.666117 -0.588462 -1.350626
C -3.292407 1.201484 0.198739
C 2.551190 -3.371079 -0.532222
C 3.058954 -2.233360 -1.195872
C 2.909802 1.632142 0.680756
C 1.154391 3.013928 -0.337085
C -4.995392 -0.190418 -1.532232
C -4.618375 1.633983 0.045692
C -5.483389 0.936033 -0.825619
C 3.714838 2.779109 0.840491
C 1.965194 4.154294 -0.185247
C 3.248094 4.040986 0.405229
H -1.163715 -1.054477 -1.074375
H 1.025665 -4.111451 0.804128
H 2.883969 -0.099962 -1.539737
H 0.732564 -2.731609 3.011516
H -0.956554 -2.209446 3.361904
H -0.670925 -3.723520 2.461949
H -3.232193 -1.451844 -1.859595
H -2.553734 1.690247 0.835154
H 3.022992 -4.348586 -0.665174
H 3.273829 0.663824 1.039781
H 0.163153 3.090304 -0.794631
H -5.633877 -0.755475 -2.214743
H -4.961409 2.501414 0.613686
H -6.520860 1.258460 -0.952276
H 4.701398 2.690698 1.306464
H 1.606580 5.130029 -0.528740
H 3.877930 4.928914 0.523303


