%chk=000233008.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233008

0 1
O 3.180967 0.009098 -0.938842
O -2.822956 -0.001897 -0.103748
O -1.875841 -0.009737 1.986678
N -0.577612 0.001670 0.048093
C 0.744144 0.000545 0.740323
C 1.495977 -1.247535 0.343286
C 1.493285 1.253009 0.352135
C 2.635781 -1.184339 -0.469225
C 2.633232 1.197997 -0.460782
C 1.063827 -2.515164 0.765460
C 1.058412 2.516698 0.783233
C 3.340931 -2.326724 -0.881537
C 3.335940 2.344781 -0.864978
C 1.749316 -3.664387 0.372056
C 1.741446 3.670138 0.397988
C -1.754692 -0.003947 0.775612
C -5.097178 -0.004081 -0.667707
C 2.881437 -3.569160 -0.452322
C 2.873786 3.583164 -0.427001
C -4.152426 -0.007107 0.527624
C -6.559866 -0.006398 -0.207076
C -7.518108 -0.004206 -1.395063
H 0.561096 -0.003637 1.856505
H -0.591905 0.005982 -0.968721
H 0.180388 -2.594090 1.402923
H 0.174785 2.589231 1.421184
H 4.218790 -2.223064 -1.515481
H 4.214027 2.247484 -1.499615
H 1.405163 -4.641934 0.704783
H 1.395194 4.644571 0.737601
H -4.889634 -0.882151 -1.312395
H -4.890730 0.878222 -1.306978
H 3.407485 -4.474606 -0.756683
H 3.397904 4.491864 -0.724932
H -4.230119 0.893210 1.159925
H -4.226605 -0.912838 1.152570
H -6.756890 0.876793 0.432980
H -6.755492 -0.893053 0.428598
H -7.378561 0.880904 -2.026772
H -7.376530 -0.885457 -2.031699
H -8.562166 -0.006352 -1.060899


%chk=000233008-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233008

0 1
O 3.414114 0.005964 -0.758826
O -2.827118 -0.033129 -0.221276
O -1.839030 -0.145617 1.919987
N -0.561115 0.031381 -0.046415
C 0.762264 0.029222 0.622734
C 1.547225 -1.241545 0.301222
C 1.551967 1.287266 0.269908
C 2.791677 -1.202005 -0.370629
C 2.797379 1.224754 -0.399352
C 1.032185 -2.510438 0.665124
C 1.042089 2.567821 0.598501
C 3.501558 -2.380010 -0.692433
C 3.513087 2.391521 -0.749107
C 1.726986 -3.697454 0.360647
C 1.742494 3.743755 0.265403
C -1.736664 -0.057574 0.665707
C -5.208080 0.019639 -0.689763
C 2.965907 -3.629130 -0.326023
C 2.982853 3.652052 -0.415967
C -4.168232 -0.126698 0.421231
C -6.650648 -0.071700 -0.136904
C -7.715589 0.082262 -1.243768
H 0.510938 0.038450 1.701252
H -0.610621 0.081558 -1.065429
H 0.071207 -2.553459 1.191368
H 0.078190 2.629095 1.117464
H 4.457728 -2.293455 -1.216925
H 4.469616 2.287026 -1.269645
H 1.312433 -4.667255 0.653972
H 1.330998 4.722647 0.531540
H -5.046728 -0.770314 -1.448505
H -5.062481 0.991380 -1.199730
H 3.512744 -4.546140 -0.570129
H 3.534403 4.559955 -0.682449
H -4.255217 0.671345 1.181795
H -4.246625 -1.102775 0.936065
H -6.801626 0.712298 0.632778
H -6.788645 -1.044614 0.377043
H -7.617260 1.058282 -1.754738
H -7.610215 -0.709364 -2.009101
H -8.738144 0.018500 -0.829527


