%chk=000291921.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291921

0 1
O 0.317295 2.558652 -0.950927
O -2.348845 -3.340300 1.804060
O 1.069886 1.898124 0.968807
O -0.199645 -3.147879 1.736089
O -4.504201 1.600803 -1.140061
O -5.244008 -0.308329 -0.430139
N 0.911853 -1.137229 0.524541
N 0.338505 1.803733 0.002839
N -1.337261 -2.742021 1.496065
N -4.360277 0.508225 -0.620512
C -0.339472 -0.625539 0.469736
C -0.656189 0.708414 0.008087
C -1.477594 -1.466214 0.800086
C 2.123752 -0.504184 0.041485
C -1.943349 1.053826 -0.375942
C -2.775624 -1.081917 0.444519
C -3.003586 0.143260 -0.189418
C 3.153911 -0.222478 0.952345
C 2.277883 -0.259612 -1.332753
C 4.520231 0.575612 -0.895446
C 4.348758 0.315316 0.475426
C 3.477150 0.280999 -1.792273
C 5.802885 1.146898 -1.397161
H 1.062475 -2.077361 0.971321
H -2.155547 2.049908 -0.807802
H -3.629344 -1.753932 0.664160
H 3.018313 -0.402835 2.019697
H 1.474218 -0.486708 -2.033685
H 5.151738 0.544231 1.177127
H 3.603152 0.480861 -2.857101
H 5.667485 1.753327 -2.304422
H 6.292049 1.796026 -0.656456
H 6.518003 0.347626 -1.647493


%chk=000291921-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291921

0 1
O -0.000944 2.782508 -1.062672
O -2.219589 -3.528554 1.569958
O 0.959321 2.077567 0.888946
O -0.043361 -2.965278 1.925701
O -4.706526 1.451495 -1.277158
O -5.369549 -0.567381 -0.428362
N 0.925320 -0.859506 0.738068
N 0.126306 1.947117 -0.086817
N -1.242871 -2.700631 1.457206
N -4.475176 0.330678 -0.676300
C -0.370327 -0.490575 0.506956
C -0.785950 0.778814 -0.056719
C -1.466303 -1.412661 0.787749
C 2.135573 -0.338720 0.183930
C -2.095340 1.036237 -0.466425
C -2.791892 -1.142219 0.408386
C -3.090287 0.059707 -0.248344
C 3.298653 -0.352183 0.992384
C 2.223531 0.074180 -1.169670
C 4.636568 0.505658 -0.891596
C 4.529763 0.069471 0.455331
C 3.461508 0.497808 -1.688665
C 5.970254 0.938111 -1.469708
H 0.991660 -1.718209 1.324787
H -2.354793 2.000828 -0.911848
H -3.577273 -1.874118 0.615494
H 3.228216 -0.663631 2.040247
H 1.343176 0.045436 -1.821252
H 5.420713 0.069135 1.093630
H 3.517551 0.821447 -2.734256
H 5.841209 1.680086 -2.276439
H 6.621569 1.381876 -0.696870
H 6.513891 0.074809 -1.900875


