%chk=000216672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216672

0 1
Cl -0.570636 -2.711185 0.817988
O -0.959004 2.382660 0.956278
N -3.502067 -0.660935 0.359442
N 0.965466 -0.509694 0.491505
N 0.766293 0.908879 0.349772
C -4.837217 -1.123505 0.869130
C -3.662868 0.419839 -0.669961
C -5.674995 -1.674360 -0.297055
C -4.487737 -0.106326 -1.855686
C -5.857652 -0.617111 -1.392826
C -2.655404 -0.182734 1.507174
C -1.240813 -0.056762 1.062110
C -0.346908 -1.042122 0.772595
C -0.575422 1.245664 0.845072
C 1.738603 -1.161412 -0.563314
C 1.914579 1.769006 0.518669
C 1.876969 -0.622240 -1.850489
C 2.380059 -2.359349 -0.203713
C 1.731928 3.137751 0.238980
C 3.175422 1.278731 0.898562
C 2.668388 -1.294509 -2.785317
C 3.159426 -3.020110 -1.155635
C 2.822472 4.002270 0.331724
C 4.254412 2.162338 0.977922
C 3.305680 -2.491370 -2.442813
C 4.085085 3.520564 0.694769
H -5.399989 -0.320284 1.391530
H -4.656855 -1.933915 1.608202
H -2.647902 0.707061 -1.021698
H -4.131624 1.339120 -0.257072
H -6.655135 -2.017757 0.079262
H -5.169600 -2.565368 -0.721487
H -3.932845 -0.927612 -2.352197
H -4.605568 0.693356 -2.608882
H -6.414219 -1.044745 -2.246743
H -6.470280 0.223010 -1.015060
H -3.002027 0.786518 1.938394
H -2.713155 -0.940470 2.324882
H 1.379111 0.311110 -2.118398
H 2.276426 -2.764115 0.802899
H 0.744005 3.520841 -0.030279
H 3.320138 0.225677 1.135788
H 2.784963 -0.882001 -3.787548
H 3.657990 -3.952225 -0.890333
H 2.685059 5.062488 0.119199
H 5.234788 1.785345 1.267876
H 3.917211 -3.012016 -3.178193
H 4.930244 4.201802 0.760275


%chk=000216672-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216672

0 1
Cl -0.600459 -2.882125 0.691757
O -1.026576 2.327834 0.988610
N -3.620677 -0.669293 0.356143
N 0.922137 -0.594374 0.374408
N 0.757290 0.832496 0.397128
C -4.937604 -1.095589 0.897048
C -3.766346 0.412567 -0.653473
C -5.858939 -1.598774 -0.232771
C -4.655205 -0.044103 -1.827072
C -6.037064 -0.511984 -1.317081
C -2.687730 -0.287012 1.455051
C -1.264482 -0.140093 0.994052
C -0.339846 -1.117373 0.707659
C -0.593066 1.152784 0.808912
C 1.844661 -1.185620 -0.575291
C 1.893902 1.699254 0.479063
C 2.023010 -0.609048 -1.855313
C 2.566925 -2.340177 -0.194665
C 1.742387 3.049300 0.069474
C 3.140144 1.236886 0.973093
C 2.929905 -1.201504 -2.759281
C 3.455525 -2.935961 -1.115622
C 2.843053 3.927039 0.160012
C 4.235230 2.123547 1.038550
C 3.643026 -2.368300 -2.397313
C 4.094774 3.471330 0.634796
H -5.449398 -0.253190 1.436335
H -4.764071 -1.902237 1.634983
H -2.760594 0.684826 -1.020504
H -4.205123 1.334738 -0.189034
H -6.837685 -1.891121 0.194491
H -5.404906 -2.501489 -0.685506
H -4.152545 -0.879931 -2.351588
H -4.764871 0.788763 -2.548188
H -6.652236 -0.895693 -2.153146
H -6.581391 0.353280 -0.884347
H -2.986854 0.676228 1.937677
H -2.746314 -1.080740 2.223934
H 1.464477 0.290796 -2.130520
H 2.433049 -2.759654 0.806864
H 0.770857 3.399944 -0.285019
H 3.248715 0.202356 1.309913
H 3.073749 -0.754841 -3.748943
H 4.009786 -3.835061 -0.825963
H 2.719636 4.970849 -0.148645
H 5.197370 1.760403 1.416394
H 4.342161 -2.826944 -3.104638
H 4.947009 4.156811 0.692880


