%chk=000296500.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296500

0 1
O -5.502985 -1.512078 -1.817313
O 5.922060 -1.950770 0.417874
O -7.548329 0.054764 -0.582578
O 7.777387 0.324067 0.376447
O 0.319572 -0.240093 2.597122
O -0.143056 1.338874 -2.492580
N -1.160081 0.658779 -0.596622
N 1.336078 0.335641 0.668287
C -1.150225 0.198963 0.746458
C 1.328590 0.716199 -0.698537
C -3.639653 -0.051211 0.918880
C 3.823841 0.717832 -0.945606
C -2.267406 -0.110730 1.437389
C 2.448936 0.902485 -1.426780
C 0.183354 0.074868 1.429294
C -0.009477 0.937304 -1.351431
C -4.001992 -0.787840 -0.222669
C 4.239752 -0.520893 -0.433176
C -4.594408 0.726903 1.582013
C 4.726817 1.792625 -1.016072
C -5.315757 -0.737155 -0.699516
C 5.560620 -0.678972 -0.000358
C -6.281214 0.067391 -0.025909
C 6.472353 0.397606 -0.093499
C -5.911248 0.790077 1.107359
C 6.047463 1.634453 -0.593509
C -6.823501 -1.547224 -2.416505
C 6.423382 -2.014324 1.782828
C -8.570440 0.846874 0.070417
C 8.614481 -0.610964 -0.361118
H -2.177546 -0.432275 2.486803
H 2.360252 1.227418 -2.475377
H -2.075131 0.801610 -1.044532
H 2.247759 0.251260 1.135101
H -3.279528 -1.423421 -0.736316
H 3.559156 -1.371508 -0.383885
H -4.318502 1.294354 2.469689
H 4.396094 2.755277 -1.405994
H -6.633816 1.407118 1.636458
H 6.759399 2.458488 -0.647217
H -6.665803 -2.226108 -3.262551
H -7.111809 -0.544535 -2.749350
H -7.549279 -1.950119 -1.702389
H 7.234410 -1.293698 1.938291
H 6.780696 -3.047738 1.848292
H 5.594757 -1.836022 2.473838
H -9.442441 0.649388 -0.566433
H -8.302669 1.907173 0.049565
H -8.739898 0.486478 1.089121
H 8.157896 -1.606906 -0.382524
H 9.540560 -0.601745 0.223462
H 8.777829 -0.226840 -1.371643


%chk=000296500-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296500

0 1
O -5.718289 -0.068054 -2.348877
O 5.972276 -1.538312 1.213683
O -7.812924 0.181639 -0.423572
O 8.061375 0.045806 -0.105818
O 0.191803 -0.378829 2.550981
O 0.011329 1.589775 -2.556768
N -1.082174 0.774659 -0.680976
N 1.280706 0.281873 0.614822
C -1.167854 0.212685 0.612907
C 1.367868 0.735537 -0.719206
C -3.725800 -0.060773 0.791959
C 3.927495 0.669513 -1.011145
C -2.341188 -0.110555 1.260236
C 2.543358 0.940015 -1.408019
C 0.118066 0.014213 1.346604
C 0.079824 1.073351 -1.400411
C -4.122491 -0.120290 -0.578712
C 4.315513 -0.312612 -0.049990
C -4.761699 0.005915 1.768019
C 4.965603 1.418434 -1.645553
C -5.474062 -0.067053 -0.967982
C 5.669322 -0.526367 0.272818
C -6.492675 0.062789 0.031008
C 6.690805 0.219269 -0.387314
C -6.116790 0.074214 1.396692
C 6.319147 1.200383 -1.334162
C -6.756862 -0.974549 -2.884455
C 6.605830 -1.047419 2.461514
C -8.864115 0.380659 0.580859
C 8.600427 -1.306856 -0.393996
H -2.183011 -0.425163 2.299462
H 2.391780 1.406726 -2.389237
H -1.950314 1.048053 -1.152004
H 2.148297 0.171140 1.148246
H -3.403829 -0.290538 -1.386864
H 3.592889 -0.988504 0.419879
H -4.493384 0.023844 2.830228
H 4.695599 2.176034 -2.389769
H -6.879599 0.150084 2.177127
H 7.114564 1.768884 -1.826178
H -6.692338 -0.854716 -3.976358
H -7.756638 -0.692914 -2.518155
H -6.532204 -2.022677 -2.607895
H 7.544193 -0.505798 2.244039
H 6.808268 -1.948363 3.059816
H 5.906924 -0.383996 3.004817
H -9.793780 0.483452 0.002710
H -8.683567 1.301453 1.167208
H -8.940311 -0.489242 1.260957
H 8.032894 -2.084207 0.147257
H 9.646963 -1.280098 -0.055364
H 8.560086 -1.501416 -1.482069


