%chk=000206821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206821

0 1
O -0.628695 -1.741771 0.203198
N -0.532908 0.509980 0.128816
N 2.460736 1.354560 0.648574
N -4.263064 0.262109 -0.307050
C 0.161873 1.781345 -0.143298
C 1.215857 2.077996 0.947899
C -1.979137 0.574361 0.477505
C 2.533741 0.073419 0.083095
C -2.851840 0.400407 -0.787294
C 1.536025 -0.875687 -0.228844
C 0.079757 -0.750828 0.047693
C 3.930366 -0.196510 -0.159668
C 3.767655 1.890345 0.743469
C 4.672315 0.961127 0.271106
C -4.774177 -1.141093 -0.467575
C -5.169146 1.255753 -0.974174
C 1.967589 -2.082564 -0.784109
C 4.313629 -1.421402 -0.724962
C 3.330001 -2.349192 -1.037627
C -4.014015 -2.107486 0.438341
C -6.446922 1.432041 -0.151413
H -0.576095 2.613356 -0.184130
H 0.645870 1.744414 -1.148935
H 1.417905 3.169930 1.007011
H 0.835959 1.763124 1.950726
H -2.210153 -0.243751 1.205111
H -2.209189 1.529574 0.989130
H -2.717324 1.264991 -1.466143
H -2.503992 -0.492455 -1.354559
H 3.942778 2.871499 1.146913
H 5.738350 1.059572 0.225897
H -5.850032 -1.140984 -0.179465
H -4.724846 -1.491794 -1.521766
H -4.637360 2.231774 -1.026894
H -5.424377 0.973381 -2.018542
H 1.221764 -2.850349 -1.019052
H 5.366233 -1.629547 -0.909279
H 3.602760 -3.306768 -1.477573
H -2.938916 -2.158578 0.192996
H -4.079732 -1.803284 1.489940
H -4.414715 -3.122048 0.355229
H -7.078747 0.536785 -0.178380
H -6.208363 1.619842 0.904600
H -7.039921 2.274406 -0.520116


%chk=000206821-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206821

0 1
O -0.561964 -1.886331 0.084208
N -0.507772 0.426173 0.162432
N 2.479442 1.418944 0.561064
N -4.297236 0.220746 -0.343293
C 0.123358 1.722408 -0.140630
C 1.226820 2.119587 0.864370
C -1.951844 0.411909 0.507399
C 2.592379 0.119908 0.044611
C -2.868271 0.287071 -0.739064
C 1.607423 -0.872312 -0.245711
C 0.123723 -0.809587 0.002868
C 4.004318 -0.128179 -0.156884
C 3.764676 1.977463 0.683701
C 4.717595 1.060627 0.257370
C -4.890432 -1.133422 -0.507558
C -5.137733 1.310831 -0.903888
C 2.091650 -2.106399 -0.751635
C 4.435623 -1.373870 -0.674230
C 3.469402 -2.354662 -0.972462
C -4.239520 -2.199965 0.394121
C -6.412150 1.584435 -0.080668
H -0.671342 2.486716 -0.107040
H 0.550412 1.731484 -1.162232
H 1.420865 3.205877 0.796645
H 0.879643 1.893503 1.891371
H -2.142199 -0.448642 1.166599
H -2.197558 1.336916 1.061209
H -2.695320 1.153246 -1.411068
H -2.562370 -0.620144 -1.298710
H 3.887143 2.990698 1.064464
H 5.794759 1.215117 0.236736
H -5.964338 -1.064195 -0.256174
H -4.830101 -1.467061 -1.576333
H -4.524296 2.231896 -0.908322
H -5.420904 1.110800 -1.970154
H 1.347281 -2.885057 -0.945650
H 5.502198 -1.569095 -0.831544
H 3.779446 -3.326804 -1.370021
H -3.163893 -2.331535 0.178425
H -4.347624 -1.920727 1.457848
H -4.736308 -3.176026 0.238800
H -7.108805 0.727381 -0.093638
H -6.146132 1.792541 0.970628
H -6.952548 2.457736 -0.491561


