%chk=000267435.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267435

0 1
O -2.535418 2.259049 0.876449
O -4.627208 0.551663 0.740395
O -4.324301 -1.799896 -0.495784
N 1.095065 0.118131 -0.496760
N 0.385591 -1.128116 -0.623005
N -3.407382 0.231188 0.142811
N -2.013325 -1.606638 -0.686109
C -1.050127 0.572623 0.061488
C -1.002974 -0.801397 -0.455197
C 0.230796 1.070216 0.082942
C 2.513309 0.046358 -0.189575
C -2.344995 1.153254 0.432141
C 3.313443 1.102887 -0.656448
C 3.062527 -1.034200 0.515009
C -3.325689 -1.154082 -0.344878
C 4.686043 1.067126 -0.402334
C 4.440174 -1.052546 0.750631
C 5.249792 -0.006532 0.296839
H 0.591671 2.041716 0.410180
H 0.669273 -1.680555 -1.445879
H 2.877863 1.931536 -1.214289
H 2.429052 -1.845758 0.879922
H 5.321281 1.881066 -0.755675
H 4.881791 -1.888093 1.296712
H 6.323333 -0.026773 0.487920
H -5.200989 0.936172 -0.009907


%chk=000267435-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267435

0 1
O -2.565265 2.548573 0.546716
O -4.756532 0.873608 0.110965
O -4.420916 -1.616214 -0.529422
N 1.085121 0.071347 -0.061865
N 0.309351 -1.079298 -0.301637
N -3.412751 0.391827 0.006824
N -2.048757 -1.588359 -0.478509
C -1.089337 0.663057 0.091183
C -1.041412 -0.743223 -0.248024
C 0.221857 1.120346 0.196671
C 2.512755 0.021405 -0.017696
C -2.385734 1.336795 0.250071
C 3.253371 1.171551 -0.386989
C 3.171247 -1.165972 0.388480
C -3.310872 -1.021466 -0.357161
C 4.661153 1.130994 -0.331954
C 4.581679 -1.196673 0.414725
C 5.331449 -0.051722 0.060575
H 0.594452 2.101772 0.478237
H 0.725328 -1.916575 -0.709097
H 2.739468 2.073726 -0.734344
H 2.598204 -2.037778 0.721977
H 5.235032 2.019175 -0.615198
H 5.092521 -2.111999 0.730469
H 6.425111 -0.080037 0.089592
H -5.267924 0.023541 -0.116988


