%chk=000288687.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288687

0 1
O -0.057158 1.526780 1.811890
O 0.092024 -2.622159 -0.111850
N -0.006131 -0.564547 0.895116
N -2.119166 3.567432 -0.171364
N -3.781157 -2.202355 0.934660
C -2.054590 0.183821 -0.993652
C -1.890456 1.013800 0.322971
C -1.872311 -1.320881 -0.611147
C -0.990492 0.572883 -2.021838
C -3.453321 0.405728 -1.572757
C -0.581032 0.732573 1.067868
C -0.514448 -1.589929 0.052214
C 1.335012 -0.803850 1.532592
C -2.006562 2.440774 0.053007
C -2.932426 -1.811609 0.256391
C 2.438328 -0.348138 0.611271
C 2.992637 -1.243720 -0.314208
C 2.905302 0.972248 0.677323
C 4.023770 -0.822318 -1.157717
C 3.936178 1.388250 -0.169211
C 4.498086 0.491734 -1.084376
H -2.726677 0.727515 1.034603
H -1.890148 -1.931049 -1.566365
H -1.068211 -0.023711 -2.939588
H -1.091109 1.624205 -2.330186
H 0.036969 0.459174 -1.651563
H -3.633440 -0.222149 -2.454893
H -4.256042 0.188826 -0.856548
H -3.596587 1.446079 -1.899653
H 1.425011 -1.891606 1.767695
H 1.365791 -0.255646 2.505357
H 2.612400 -2.265537 -0.377165
H 2.457589 1.673651 1.385145
H 4.458839 -1.519366 -1.872253
H 4.301903 2.412758 -0.114895
H 5.304324 0.816936 -1.739776


%chk=000288687-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288687

0 1
O -0.069918 1.582130 1.786961
O 0.093362 -2.637384 -0.189952
N -0.003249 -0.537214 0.823661
N -2.297993 3.614402 -0.092235
N -3.789096 -2.202281 1.061259
C -2.136222 0.193426 -1.015597
C -1.949645 1.004870 0.316827
C -1.917859 -1.309612 -0.622233
C -1.089013 0.604741 -2.081474
C -3.563546 0.400674 -1.574152
C -0.602478 0.733962 1.032158
C -0.525162 -1.562735 0.005044
C 1.335301 -0.783441 1.477058
C -2.123346 2.453206 0.109237
C -2.953593 -1.808476 0.306063
C 2.502825 -0.349526 0.597860
C 3.113557 -1.272453 -0.289983
C 2.999175 0.977999 0.669997
C 4.200775 -0.871392 -1.098227
C 4.085683 1.377586 -0.139772
C 4.688958 0.454280 -1.025474
H -2.744086 0.677705 1.024377
H -1.948755 -1.933376 -1.534922
H -1.234536 0.015685 -3.004474
H -1.212102 1.670831 -2.339451
H -0.047313 0.457350 -1.744309
H -3.715544 -0.217866 -2.477169
H -4.340896 0.127907 -0.838010
H -3.714975 1.456372 -1.858644
H 1.377229 -1.863819 1.686306
H 1.318587 -0.217265 2.421337
H 2.729926 -2.297466 -0.346829
H 2.528935 1.691662 1.356078
H 4.669218 -1.591420 -1.778405
H 4.463868 2.403813 -0.075921
H 5.534626 0.763725 -1.649892


