%chk=000261220.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261220

0 1
O 2.851141 -0.169975 -0.486649
O 5.975228 0.885566 0.049248
O 5.475942 -1.312046 -0.210331
N -4.716116 0.616822 -0.914275
N -3.392294 0.563377 -1.081767
N -2.642332 0.760182 -0.066034
C -5.977050 -0.100748 1.154830
C -5.408573 1.079080 0.324937
C -7.103637 -0.827644 0.413257
C -4.875170 -1.076159 1.571947
C -5.461879 0.776830 -2.190730
C -1.237964 0.517388 -0.237623
C 1.506837 0.115081 -0.305892
C -0.664071 -0.243304 -1.281704
C -0.420413 1.066822 0.767454
C 0.708116 -0.449015 -1.321141
C 0.962809 0.869605 0.738036
C 3.768831 0.323712 0.519311
C 5.124183 -0.195357 0.061486
C 7.377044 0.658405 -0.307907
C 8.114166 0.037731 0.859447
H -6.410102 0.356152 2.083450
H -6.227269 1.779565 0.059198
H -4.695530 1.655287 0.962813
H -7.552210 -1.602364 1.045834
H -7.902776 -0.143967 0.113351
H -6.729608 -1.328923 -0.487520
H -4.467547 -1.617577 0.708782
H -4.028321 -0.552249 2.034074
H -5.243601 -1.819287 2.284768
H -5.632227 1.836264 -2.444173
H -6.435419 0.265310 -2.099498
H -4.911399 0.310659 -3.028712
H -1.302630 -0.670638 -2.056496
H -0.871762 1.649234 1.572340
H 1.177564 -1.033529 -2.110654
H 1.580617 1.301902 1.517376
H 3.735184 1.431139 0.541588
H 3.511550 -0.101506 1.508763
H 7.407733 0.029731 -1.215706
H 7.700790 1.691516 -0.532185
H 7.772110 -0.991802 1.045546
H 7.958112 0.605186 1.785659
H 9.194142 -0.006055 0.673306


%chk=000261220-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261220

0 1
O 2.915794 0.181766 -0.854476
O 6.074779 0.834508 0.792504
O 5.638898 0.038711 -1.366237
N -4.787790 0.348168 -1.021271
N -3.434022 0.232362 -1.209576
N -2.699734 0.652812 -0.202946
C -5.960791 0.131473 1.256346
C -5.397472 1.051656 0.134133
C -7.136518 -0.751148 0.773560
C -4.856457 -0.728505 1.911765
C -5.578497 0.091131 -2.231883
C -1.293605 0.506195 -0.422116
C 1.530727 0.323773 -0.633715
C -0.689148 -0.063966 -1.583603
C -0.456885 0.974005 0.621096
C 0.706089 -0.153113 -1.685209
C 0.949014 0.889324 0.526821
C 3.798853 0.669876 0.189670
C 5.239835 0.455388 -0.264517
C 7.548367 0.708983 0.554540
C 8.028332 -0.710519 0.867053
H -6.356724 0.831852 2.024030
H -6.214008 1.688177 -0.261920
H -4.609026 1.700074 0.559343
H -7.596951 -1.281274 1.627654
H -7.926467 -0.151362 0.282042
H -6.786479 -1.519780 0.059366
H -4.423101 -1.431268 1.176510
H -4.031517 -0.102602 2.293323
H -5.271148 -1.320016 2.749514
H -5.867680 1.036523 -2.736104
H -6.496811 -0.466133 -1.983597
H -4.963505 -0.504739 -2.923478
H -1.329664 -0.428843 -2.391637
H -0.929318 1.407592 1.508718
H 1.188751 -0.585715 -2.567150
H 1.562676 1.261101 1.352882
H 3.645215 1.752805 0.378730
H 3.640912 0.130401 1.145614
H 7.756816 0.982297 -0.494986
H 7.983682 1.456466 1.236560
H 7.583554 -1.437438 0.167115
H 7.765034 -0.998502 1.899428
H 9.128189 -0.762094 0.763907


