%chk=000182881.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182881

0 1
O 2.589642 0.151144 0.289875
O -0.530324 2.518260 0.135770
O 1.596014 2.235029 0.238365
O -3.842681 -1.082492 -0.057976
N -2.182430 0.535989 0.039461
N 0.468589 1.784112 0.181822
C 0.266357 0.352993 0.166458
C -1.029787 -0.267009 0.095938
C 1.411573 -0.508822 0.223647
C -1.123304 -1.672034 0.084541
C 1.289925 -1.903197 0.210628
C 0.014824 -2.467228 0.140657
C 3.846855 -0.620451 0.352851
C -3.539674 0.088870 -0.035224
C 4.886803 0.476022 0.425281
C -4.520385 1.221602 -0.080878
H -2.110460 -2.150426 0.030454
H 2.161067 -2.546651 0.253555
H -0.090349 -3.556206 0.129928
H -2.023881 1.577289 0.053879
H 3.818112 -1.253949 1.254896
H 3.920797 -1.230680 -0.562714
H 5.903492 0.068017 0.435874
H 4.800671 1.164792 -0.429899
H 4.754362 1.097223 1.324163
H -4.471352 1.860452 0.813827
H -5.550091 0.828835 -0.138966
H -4.375865 1.872016 -0.956712


%chk=000182881-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182881

0 1
O 2.648222 0.221801 0.301319
O -0.785921 2.577840 0.150261
O 1.465842 2.440500 0.230204
O -3.951537 -1.147150 -0.081186
N -2.254076 0.497500 0.039826
N 0.325997 1.855009 0.185126
C 0.220171 0.394898 0.170829
C -1.076501 -0.264492 0.096865
C 1.420948 -0.414542 0.229224
C -1.131985 -1.684732 0.081235
C 1.313658 -1.824985 0.212887
C 0.048699 -2.437872 0.139015
C 3.882092 -0.604821 0.360455
C -3.587846 0.063685 -0.045869
C 5.045874 0.378449 0.421757
C -4.580349 1.222168 -0.086503
H -2.111742 -2.159370 0.023375
H 2.210972 -2.444922 0.257949
H -0.016380 -3.531083 0.126752
H -2.058338 1.521430 0.067526
H 3.843661 -1.250330 1.260797
H 3.934174 -1.244212 -0.543603
H 6.001902 -0.174432 0.468484
H 5.055805 1.026227 -0.470296
H 4.966294 1.021659 1.313648
H -4.499927 1.846371 0.822275
H -5.598711 0.814170 -0.154162
H -4.392501 1.874737 -0.958691


