%chk=000200889.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200889

0 1
O -0.650637 -0.568071 -0.399584
O 3.951223 -1.162711 -0.968158
O 4.498570 1.003694 0.865025
N -4.241502 -0.027050 -0.038185
C -2.980464 -0.718947 -0.446603
C -5.317055 -0.998270 0.348326
C -4.706142 0.922055 -1.105392
C -1.827543 0.077020 0.184349
C -4.980394 -1.646999 1.691409
C -5.651686 1.961103 -0.501337
C 0.590372 -0.115564 -0.025728
C 2.938755 -0.448325 -0.359543
C 3.200000 0.597747 0.562296
C 1.634040 -0.823606 -0.659615
C 5.268676 -0.549858 -0.845829
C 5.484377 -0.020980 0.569518
C 0.832667 0.930797 0.875357
C 2.154626 1.283614 1.175144
H -2.833618 -0.789769 -1.545958
H -2.948938 -1.766701 -0.075270
H -6.270745 -0.430832 0.447280
H -5.490442 -1.778652 -0.423647
H -3.815123 1.442435 -1.523477
H -5.198495 0.404241 -1.956747
H -1.793668 -0.028914 1.280532
H -1.830952 1.140639 -0.103429
H -4.107733 -2.306694 1.624705
H -4.746500 -0.884033 2.446499
H -5.821753 -2.240779 2.062716
H -6.605325 1.518997 -0.191244
H -5.208603 2.420965 0.392849
H -5.868126 2.759251 -1.218645
H 1.418065 -1.628585 -1.357045
H 5.325120 0.252664 -1.603744
H 5.937983 -1.386445 -1.112189
H 5.393968 -0.815922 1.331610
H 6.435738 0.526239 0.690764
H 0.019881 1.470319 1.349020
H 2.373381 2.086625 1.878074


%chk=000200889-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200889

0 1
O -0.648638 -0.683377 -0.497585
O 4.096266 -1.208002 -0.910339
O 4.541807 1.052361 0.907886
N -4.307161 -0.082908 -0.053027
C -3.060207 -0.763565 -0.483468
C -5.385255 -1.020138 0.358632
C -4.756662 0.951580 -1.024253
C -1.836768 -0.005068 0.048228
C -5.114508 -1.679044 1.724575
C -5.607902 2.061753 -0.379279
C 0.613142 -0.193671 -0.116902
C 3.024511 -0.482170 -0.337519
C 3.239930 0.620150 0.539089
C 1.718709 -0.889831 -0.657399
C 5.397021 -0.514302 -0.791345
C 5.574599 0.034142 0.627814
C 0.816128 0.920396 0.738587
C 2.134000 1.312532 1.061322
H -2.983251 -0.852526 -1.591459
H -3.034802 -1.791625 -0.081956
H -6.324310 -0.441851 0.428774
H -5.557827 -1.811077 -0.414969
H -3.852050 1.413370 -1.463193
H -5.318059 0.491299 -1.877072
H -1.826751 -0.032385 1.155562
H -1.853190 1.054488 -0.281127
H -4.186534 -2.279513 1.715219
H -5.011232 -0.906259 2.506109
H -5.946208 -2.354378 1.999706
H -6.546640 1.667879 0.050440
H -5.042627 2.551591 0.432726
H -5.880620 2.823971 -1.132942
H 1.559993 -1.738354 -1.327762
H 5.440644 0.309812 -1.529883
H 6.157895 -1.273849 -1.033122
H 5.494989 -0.785872 1.368644
H 6.540556 0.551360 0.744642
H -0.025687 1.475253 1.160121
H 2.318698 2.158528 1.730627


