%chk=000289366.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289366

0 1
O 0.530852 0.857686 0.520979
O 3.683272 1.892916 -0.653118
O 2.316212 -1.567337 -0.622945
O 2.323090 2.786706 0.939914
O 3.023558 -0.790892 1.392566
O -4.342478 -2.384356 -1.775059
O -5.321359 -1.104705 -0.331899
N -4.331861 -1.513292 -0.918417
C 1.774207 0.654756 -0.186015
C -0.599596 0.205872 0.075757
C 2.578225 1.917615 0.156626
C 2.455971 -0.613738 0.350535
C -1.757498 0.653183 0.751808
C -0.639658 -0.794077 -0.905094
C -3.034280 -0.916794 -0.570408
C -2.976963 0.084866 0.423236
C -1.873033 -1.354804 -1.228645
C 4.651760 2.992042 -0.532064
C 2.836699 -2.915878 -0.354613
C 4.105344 4.237507 -1.191457
C 1.896125 -3.648393 0.574223
H 1.608216 0.588635 -1.291598
H -1.668920 1.430704 1.513133
H 0.268779 -1.153391 -1.394336
H -3.901180 0.403070 0.921952
H -1.946960 -2.138853 -1.992576
H 4.879541 3.134469 0.539314
H 5.514844 2.551138 -1.065685
H 2.858255 -3.329260 -1.380096
H 3.858074 -2.817551 0.054000
H 4.865427 5.027745 -1.244826
H 3.761000 4.040657 -2.215156
H 3.249511 4.647580 -0.632865
H 2.168570 -4.707838 0.666890
H 1.913205 -3.219491 1.588258
H 0.856548 -3.604392 0.222983


%chk=000289366-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289366

0 1
O 0.247244 1.095128 0.521490
O 3.688332 1.774018 -0.275154
O 2.481897 -1.273249 -0.727028
O 1.986679 3.195570 0.472095
O 2.455533 -0.681250 1.538197
O -4.512097 -2.661214 -1.525389
O -5.601305 -1.322844 -0.030770
N -4.535404 -1.700653 -0.658417
C 1.504740 0.842719 -0.175529
C -0.879487 0.341536 0.173839
C 2.382759 2.089330 0.070572
C 2.195913 -0.435940 0.344994
C -2.067982 0.725629 0.848238
C -0.887324 -0.719241 -0.770307
C -3.273114 -0.994617 -0.369184
C -3.269832 0.057697 0.579078
C -2.096221 -1.386815 -1.041762
C 4.700992 2.878388 -0.161597
C 3.211162 -2.547491 -0.405540
C 4.704486 3.739951 -1.425571
C 2.229692 -3.647135 0.004830
H 1.347203 0.747155 -1.267598
H -2.017502 1.546895 1.568041
H 0.026315 -1.040551 -1.278068
H -4.201484 0.331450 1.080230
H -2.141928 -2.207803 -1.762056
H 4.462085 3.472062 0.737715
H 5.648607 2.336152 -0.020033
H 3.736368 -2.781248 -1.344687
H 3.937603 -2.331661 0.397151
H 5.512852 4.490982 -1.355662
H 4.884216 3.124845 -2.323868
H 3.748415 4.277159 -1.540947
H 2.781989 -4.592676 0.157343
H 1.720978 -3.392072 0.949140
H 1.471120 -3.818102 -0.778484


