%chk=000211979.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211979

0 1
O 0.149043 -2.834957 0.867157
O 1.958316 -0.641703 0.453534
N -2.184985 -0.115403 0.083132
C -2.598577 0.671577 1.301941
C -3.054725 0.012352 -1.137919
C -4.081672 1.128920 1.220634
C -3.555063 1.476026 -1.243247
C -4.413240 1.912658 -0.051990
C -1.689487 -1.497727 0.310317
C -1.655600 1.893976 1.358783
C -2.447905 -0.114577 2.623870
C -4.248190 -0.968625 -1.139394
C -2.172081 -0.276256 -2.376755
C -0.212341 -1.443299 0.761053
C 0.688626 -0.739470 -0.261605
C 3.021523 -0.042083 -0.190250
C 4.198238 0.020568 0.605152
C 2.982820 0.464157 -1.491180
C 5.332192 0.605750 0.043005
C 4.211689 -0.533834 1.989910
C 4.142688 1.045362 -2.022206
C 5.309040 1.116540 -1.264388
H -4.326795 1.738924 2.108686
H -4.732945 0.232795 1.278862
H -4.119868 1.604248 -2.183855
H -2.673094 2.144275 -1.324823
H -5.486708 1.785356 -0.290265
H -4.270606 2.996509 0.123366
H -2.274671 -2.074342 1.059759
H -1.746224 -2.098433 -0.627450
H -1.901405 2.550330 2.196768
H -0.610800 1.582356 1.465245
H -1.716076 2.485696 0.438242
H -1.404609 -0.408736 2.806472
H -2.753503 0.498504 3.478078
H -3.056378 -1.024189 2.639222
H -3.925355 -2.010768 -1.211605
H -4.844477 -0.872879 -0.224181
H -4.915569 -0.776833 -1.984507
H -2.735460 -0.134384 -3.303159
H -1.301900 0.387956 -2.404381
H -1.794687 -1.305040 -2.377188
H -0.096757 -0.980180 1.771080
H 0.322005 0.276040 -0.499949
H 0.835107 -1.334639 -1.176633
H 1.117316 -2.915105 1.008559
H 2.081723 0.417092 -2.092697
H 6.250514 0.668215 0.626072
H 4.808293 0.081461 2.675062
H 3.195352 -0.600026 2.409328
H 4.631730 -1.549775 2.001336
H 4.123700 1.442231 -3.036157
H 6.206235 1.567789 -1.680339


%chk=000211979-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211979

0 1
O 0.291472 -2.653302 1.195467
O 2.085806 -0.598738 0.516283
N -2.340279 -0.149424 0.222896
C -2.865386 0.638174 1.404849
C -2.989403 0.010940 -1.126822
C -4.325878 1.117438 1.141860
C -3.501780 1.472446 -1.264395
C -4.515939 1.906449 -0.176526
C -1.638890 -1.419817 0.476819
C -1.946515 1.871266 1.673325
C -2.922463 -0.211891 2.705881
C -4.157101 -1.003046 -1.363209
C -1.943113 -0.191128 -2.262070
C -0.165911 -1.277550 0.936348
C 0.739648 -0.606704 -0.095124
C 3.151127 -0.052127 -0.226981
C 4.420104 -0.080232 0.423149
C 3.000336 0.494420 -1.523293
C 5.526010 0.458308 -0.271991
C 4.554230 -0.673358 1.810948
C 4.128331 1.024471 -2.191623
C 5.394270 1.008870 -1.570168
H -4.647945 1.736806 2.001242
H -4.977442 0.222919 1.143431
H -3.951788 1.587992 -2.268900
H -2.615724 2.135552 -1.238653
H -5.551948 1.760460 -0.536301
H -4.404162 2.991718 0.006285
H -2.133363 -2.051516 1.241652
H -1.629100 -2.028918 -0.443550
H -2.306077 2.455472 2.543108
H -0.912930 1.541733 1.884283
H -1.912537 2.540936 0.797286
H -1.930586 -0.569459 3.031375
H -3.327692 0.417174 3.519009
H -3.590029 -1.085089 2.592006
H -3.807077 -2.041249 -1.212973
H -4.998059 -0.827449 -0.671702
H -4.541967 -0.924893 -2.397962
H -2.405889 0.043400 -3.238509
H -1.083767 0.486858 -2.115371
H -1.568387 -1.228243 -2.320178
H -0.109053 -0.686783 1.875315
H 0.400271 0.426198 -0.298583
H 0.765886 -1.192679 -1.035686
H 1.267383 -2.606901 1.370957
H 2.023793 0.513108 -2.015826
H 6.508162 0.444621 0.215936
H 5.587564 -0.573469 2.184239
H 3.871701 -0.178025 2.525552
H 4.287063 -1.747173 1.815744
H 4.009779 1.446970 -3.195614
H 6.269641 1.418864 -2.084736


