%chk=000200895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200895

1 1
O -0.504198 0.637250 1.764222
O 0.290428 0.556291 -0.993893
O 3.131843 0.487662 -1.528870
N -2.985906 -0.114049 0.195555
C -1.958385 -1.246778 0.350285
C -4.353660 -0.781942 0.418388
C -2.676838 -2.533789 -0.056399
C -4.187215 -2.242881 -0.019429
C -2.763372 0.993609 1.221233
C -2.917976 0.457097 -1.202274
C -1.370787 1.623806 1.141142
C 0.830028 0.656638 1.364832
C 1.249078 0.578542 0.023810
C 1.763049 0.660666 2.406441
C 2.633572 0.545861 -0.246751
C 0.839073 0.125165 -2.279284
C 3.129716 0.576068 2.110840
C 3.577197 0.528351 0.791357
C 2.159743 0.833575 -2.554931
H -1.598687 -1.283675 1.408364
H -1.043764 -1.028636 -0.253517
H -5.151128 -0.256310 -0.146358
H -4.631787 -0.724306 1.494980
H -2.411011 -3.363789 0.630406
H -2.362514 -2.877771 -1.060745
H -4.653102 -2.427329 -1.006983
H -4.710170 -2.925046 0.681631
H -3.545285 1.779325 1.099734
H -2.894033 0.565026 2.250411
H -3.645682 1.272848 -1.352671
H -1.904060 0.862747 -1.415182
H -3.123130 -0.322836 -1.959593
H -1.037221 1.859770 0.111906
H -1.312675 2.537649 1.768266
H 1.415559 0.723097 3.438097
H 0.040878 0.406960 -2.986442
H 0.961273 -0.973183 -2.233910
H 2.663231 0.486022 -3.478546
H 2.061040 1.935180 -2.564107
H 3.855960 0.562903 2.928463
H 4.640817 0.484014 0.548821


%chk=000200895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200895

1 1
O -0.362244 0.244943 1.297957
O 0.654498 0.679858 -1.291932
O 3.526713 1.169726 -1.606163
N -3.077616 -0.362470 0.330443
C -2.521393 -1.691574 0.907354
C -4.606293 -0.586998 0.412706
C -3.453351 -2.783523 0.345238
C -4.826068 -2.078592 0.072364
C -2.689196 0.872862 1.165719
C -2.647063 -0.198531 -1.123361
C -1.258335 1.364644 0.965042
C 1.030641 0.504814 1.114448
C 1.550852 0.713071 -0.187419
C 1.879477 0.466882 2.235296
C 2.947009 0.927635 -0.345600
C 1.360292 0.548576 -2.597856
C 3.272399 0.641759 2.056478
C 3.804869 0.880182 0.773837
C 2.542015 1.518428 -2.652045
H -2.595549 -1.606895 2.004185
H -1.460120 -1.774048 0.640859
H -5.107257 0.119262 -0.268314
H -4.900650 -0.356028 1.450515
H -3.553107 -3.603721 1.073828
H -3.044284 -3.224260 -0.578723
H -5.138326 -2.210871 -0.976106
H -5.629401 -2.491989 0.702435
H -3.391715 1.680839 0.892946
H -2.856823 0.595076 2.220149
H -3.074689 0.737445 -1.517167
H -1.547520 -0.166162 -1.176391
H -3.029993 -1.050084 -1.704241
H -1.069405 1.718574 -0.065130
H -1.092048 2.211655 1.660845
H 1.445789 0.293108 3.224137
H 0.606905 0.783323 -3.366350
H 1.708210 -0.495255 -2.709630
H 3.083964 1.437846 -3.606976
H 2.202751 2.561335 -2.502205
H 3.940465 0.604811 2.921614
H 4.875496 1.038149 0.616511


