%chk=000287811.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287811

0 1
O 0.758596 2.361601 1.084064
O -4.112023 1.142999 0.011453
O 0.453911 2.789618 -1.123863
O -2.653342 2.855788 0.239136
N -0.892006 -1.402798 -0.151078
C 0.188804 -0.487634 -0.175602
C -2.151740 -0.809308 -0.067731
C -0.519195 -2.757509 -0.224535
C 1.359134 -1.355424 -0.265635
C -0.435130 0.770637 -0.111886
C -1.850973 0.596078 -0.032690
C 0.938028 -2.680920 -0.295724
C -3.209763 -1.745291 -0.049439
C -1.591208 -3.632050 -0.204230
C 2.737565 -0.872949 -0.300151
C -2.912180 -3.104024 -0.116507
C 0.267484 2.075878 -0.172612
C -2.828066 1.668212 0.086120
C 3.693876 -1.523086 -1.100024
C 3.115694 0.238917 0.472638
C 5.012653 -1.063765 -1.123689
C 4.437451 0.688170 0.447497
C 5.386698 0.039645 -0.349690
C 1.403948 3.655706 1.240529
C -5.195881 2.103219 0.120712
H 1.568580 -3.549124 -0.348141
H -4.236302 -1.376675 0.013532
H -1.439371 -4.708357 -0.254903
H -3.737409 -3.821195 -0.103037
H 3.403853 -2.377775 -1.709867
H 2.375707 0.750046 1.096495
H 5.750434 -1.565632 -1.748136
H 4.728671 1.547408 1.049991
H 6.415895 0.395020 -0.369510
H 1.773656 3.613142 2.269852
H 2.212221 3.761534 0.510390
H 0.654468 4.444465 1.109445
H -6.082642 1.482446 -0.038013
H -5.088747 2.872199 -0.652018
H -5.181050 2.555387 1.117358


%chk=000287811-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287811

0 1
O 0.512581 2.544467 1.178387
O -4.116848 1.177652 0.189525
O 0.596057 2.655066 -1.149708
O -2.503942 2.872732 0.208111
N -0.865997 -1.454443 -0.171268
C 0.200198 -0.563665 -0.162920
C -2.120688 -0.869142 -0.068654
C -0.495872 -2.787064 -0.328955
C 1.388013 -1.396608 -0.312737
C -0.409738 0.724451 -0.049847
C -1.834623 0.548656 0.018900
C 0.945116 -2.746265 -0.418375
C -3.197394 -1.782646 -0.093107
C -1.581393 -3.689598 -0.352310
C 2.788595 -0.940432 -0.330145
C -2.903761 -3.169114 -0.230104
C 0.269461 2.056498 -0.102457
C -2.790270 1.648262 0.144649
C 3.787048 -1.688898 -1.014924
C 3.180178 0.244097 0.355017
C 5.132326 -1.268385 -1.014371
C 4.526230 0.664304 0.353311
C 5.509412 -0.087980 -0.330511
C 1.028069 3.935921 1.233545
C -5.147728 2.233135 0.313243
H 1.590304 -3.618831 -0.505389
H -4.222207 -1.417672 -0.013429
H -1.414202 -4.763323 -0.468413
H -3.741139 -3.874543 -0.249675
H 3.499683 -2.587299 -1.572880
H 2.435738 0.815785 0.920048
H 5.885347 -1.853149 -1.554312
H 4.810208 1.575371 0.891710
H 6.554410 0.241028 -0.332685
H 1.165289 4.141435 2.304165
H 1.979712 4.017226 0.681342
H 0.283164 4.615481 0.787884
H -6.105618 1.693695 0.312718
H -5.085263 2.932872 -0.537243
H -5.010160 2.795521 1.252365


