%chk=000239997.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239997

0 1
S 1.525624 -0.468635 0.243337
N -1.217963 -0.485201 0.224779
N -0.308297 1.398680 -0.669668
C -2.287216 0.345044 -0.178815
C -3.688936 -0.020339 -0.012809
C 2.640743 0.830194 -0.391652
C -0.041874 0.202977 -0.092356
C 4.009449 0.300431 -0.129262
C -1.699200 1.495544 -0.724608
C -4.604606 0.945404 0.440177
C -4.134799 -1.319474 -0.310259
C 4.661476 -0.481477 -1.096791
C 4.654445 0.581712 1.086264
C -5.951105 0.609396 0.596322
C -5.483211 -1.646847 -0.148381
C -6.392350 -0.685739 0.305270
C 5.945968 -0.972156 -0.849570
C 5.938937 0.087754 1.326854
C 6.586946 -0.688640 0.360738
H 2.436512 1.794181 0.119050
H 2.439482 1.016639 -1.467027
H -1.305327 -1.378749 0.673756
H -2.184391 2.356529 -1.150029
H -4.260401 1.952731 0.672226
H -3.437107 -2.066237 -0.683712
H 4.165810 -0.708416 -2.039762
H 4.153261 1.182875 1.843784
H -6.659115 1.359259 0.947298
H -5.827497 -2.653722 -0.380987
H -7.442365 -0.944423 0.429440
H 6.448418 -1.577589 -1.602461
H 6.435879 0.308407 2.270370
H 7.587709 -1.071616 0.550481


%chk=000239997-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239997

0 1
S 1.497938 -0.801882 0.235159
N -1.301765 -0.615445 0.179473
N -0.265823 1.302300 -0.421671
C -2.335286 0.309585 -0.098490
C -3.761573 -0.011508 -0.001091
C 2.641057 0.690873 -0.190770
C -0.085231 0.025781 -0.022377
C 4.079620 0.259317 -0.066072
C -1.655388 1.480836 -0.466576
C -4.727027 1.035694 0.037511
C -4.227400 -1.356694 0.054256
C 4.763536 -0.302997 -1.175488
C 4.774930 0.411990 1.161692
C -6.102983 0.747009 0.123102
C -5.605672 -1.642977 0.150432
C -6.552957 -0.594129 0.184431
C 6.114229 -0.699944 -1.062231
C 6.125902 0.016238 1.277412
C 6.799281 -0.541168 0.165266
H 2.359585 1.489905 0.510830
H 2.359696 0.995811 -1.209474
H -1.429777 -1.566420 0.521411
H -2.078689 2.430644 -0.785154
H -4.391015 2.078106 0.015988
H -3.518721 -2.192093 -0.007763
H 4.233329 -0.427028 -2.127382
H 4.253841 0.842857 2.025057
H -6.827144 1.568829 0.152382
H -5.940589 -2.685576 0.189109
H -7.622883 -0.816617 0.256902
H 6.631629 -1.129141 -1.927461
H 6.652466 0.143373 2.229843
H 7.847784 -0.847033 0.253740


