%chk=000208900.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208900

0 1
O 0.946321 -0.988336 -0.868809
O 1.559599 2.424481 0.056578
O 3.683558 0.662342 1.546036
O 3.173239 -1.724759 0.703176
O -1.984966 1.087903 -1.464828
O -4.094096 -1.556373 1.501027
N -0.715840 0.119931 0.208065
N -3.138222 -0.185458 0.087567
N -3.075581 -1.118718 1.067258
C 3.060879 0.634052 0.267606
C 1.576488 1.044664 0.453147
C 3.278794 -0.765639 -0.357949
C 0.556033 0.358790 -0.499264
C 2.257558 -1.072940 -1.454362
C -1.918182 0.371403 -0.487606
C -4.423129 0.315054 -0.479186
H 3.585255 1.440705 -0.305883
H 1.293779 0.947282 1.524835
H 4.333479 -0.885136 -0.700073
H 0.411281 0.971014 -1.430049
H 2.340024 -0.400695 -2.325348
H 2.300268 -2.128818 -1.789191
H -0.686981 -0.634975 0.904729
H 0.890985 2.925526 0.571262
H 3.656788 -0.242582 1.968311
H 2.221320 -1.962603 0.845956
H -4.833562 1.120910 0.151994
H -5.162889 -0.503056 -0.527159
H -4.273101 0.714531 -1.499840


%chk=000208900-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208900

0 1
O 0.960623 -1.190002 -0.774275
O 1.270117 2.208571 0.826652
O 3.950632 0.941826 1.258954
O 3.427225 -1.699369 0.644323
O -1.876211 0.830360 -1.816359
O -4.211279 -0.720007 1.825641
N -0.785252 0.118213 0.143812
N -3.153356 0.072024 0.008044
N -3.077597 -0.468480 1.296114
C 3.015453 0.682436 0.169405
C 1.544892 0.784474 0.649094
C 3.333542 -0.704241 -0.450620
C 0.553714 0.190881 -0.390679
C 2.270527 -1.139997 -1.464777
C -1.892694 0.368784 -0.648684
C -4.440073 0.314848 -0.665015
H 3.185386 1.484014 -0.572098
H 1.439976 0.223642 1.605842
H 4.340704 -0.679280 -0.898979
H 0.532899 0.831177 -1.294953
H 2.223000 -0.446128 -2.329394
H 2.453123 -2.165853 -1.821163
H -0.956324 -0.337708 1.047723
H 0.393212 2.321433 1.274272
H 4.078333 0.068224 1.722996
H 2.507230 -2.041046 0.808970
H -5.050045 1.015106 -0.069176
H -4.998257 -0.632059 -0.762127
H -4.220399 0.736660 -1.655545


