%chk=000201393.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201393

0 1
O 1.908803 1.243981 -0.665255
O -4.331930 1.346763 -1.103070
O -2.048953 1.207781 2.922789
O 1.462354 -2.597960 -1.928282
N -3.172697 1.629395 0.912955
N 6.039612 -2.398690 0.275751
C -1.796466 3.396926 -0.204247
C -2.903541 3.083596 0.813089
C -0.414879 2.943495 0.277719
C 0.667179 3.227741 -0.770664
C -3.840202 0.870787 -0.113697
C -2.656879 0.796629 1.969304
C -3.773529 -0.555131 0.358454
C -3.070258 -0.598999 1.595385
C 2.025479 2.667349 -0.355013
C -4.265895 -1.702159 -0.224117
C -2.857325 -1.789847 2.254290
C 2.982197 0.425999 -0.367214
C -4.047071 -2.928251 0.449668
C -3.360845 -2.970965 1.657267
C 2.734543 -0.942011 -0.649066
C 4.206193 0.851232 0.152469
C 3.738131 -1.868947 -0.396568
C 1.394694 -1.364884 -1.188673
C 4.984160 -1.450504 0.124290
C 5.209690 -0.091556 0.399550
C 2.069575 -2.474378 -3.229867
H -1.792579 4.487085 -0.402007
H -2.039000 2.920409 -1.177238
H -2.628546 3.455491 1.827999
H -3.849727 3.590111 0.511004
H -0.163354 3.439590 1.235156
H -0.426377 1.856016 0.501226
H 0.756264 4.315549 -0.954179
H 0.376157 2.773501 -1.742980
H 2.852385 3.085476 -0.953712
H 2.231742 2.779115 0.722473
H -4.803955 -1.673394 -1.172451
H -2.318430 -1.827880 3.201788
H -4.425077 -3.849567 0.003390
H -3.199832 -3.925799 2.160391
H 4.397855 1.898079 0.366583
H 3.550875 -2.921304 -0.620493
H 0.934433 -0.571131 -1.808274
H 0.703267 -1.637130 -0.364761
H 6.167417 0.239032 0.794411
H 5.731830 -3.353956 0.406205
H 6.732251 -2.151677 0.970457
H 1.471983 -1.815508 -3.865836
H 3.098017 -2.109793 -3.143056
H 2.048863 -3.504409 -3.602945


%chk=000201393-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201393

0 1
O 1.844253 1.245883 -0.577822
O -4.207088 1.297239 -1.282759
O -2.246078 1.293504 3.000252
O 1.405855 -2.739879 -1.795588
N -3.169388 1.638695 0.831375
N 6.077658 -2.413561 0.300973
C -1.817665 3.507823 -0.173980
C -2.989867 3.098029 0.749670
C -0.455949 2.926145 0.261507
C 0.696903 3.368824 -0.665482
C -3.750973 0.847755 -0.201089
C -2.765156 0.845732 1.947583
C -3.697049 -0.566821 0.294287
C -3.104837 -0.567634 1.580916
C 2.028828 2.685631 -0.339212
C -4.120424 -1.756166 -0.316629
C -2.914876 -1.757395 2.298895
C 2.948927 0.391990 -0.339646
C -3.931343 -2.966626 0.400690
C -3.337418 -2.967285 1.688166
C 2.722944 -0.991713 -0.581748
C 4.214696 0.831518 0.111491
C 3.769399 -1.907660 -0.359822
C 1.352639 -1.478496 -1.043690
C 5.050505 -1.482873 0.092900
C 5.256391 -0.096719 0.326072
C 1.928984 -2.559449 -3.152331
H -1.773094 4.616062 -0.179497
H -2.048088 3.193328 -1.210038
H -2.811856 3.447553 1.782770
H -3.933777 3.537688 0.379867
H -0.235841 3.227606 1.305917
H -0.500835 1.821261 0.256465
H 0.844615 4.465901 -0.593807
H 0.436021 3.146635 -1.719063
H 2.842616 3.069396 -0.990005
H 2.312912 2.852731 0.722023
H -4.575145 -1.743972 -1.312061
H -2.454775 -1.745716 3.291860
H -4.244180 -3.915968 -0.046883
H -3.201018 -3.917138 2.216047
H 4.406265 1.891566 0.302556
H 3.569970 -2.968553 -0.555858
H 0.851066 -0.687943 -1.638225
H 0.709556 -1.707810 -0.173862
H 6.232803 0.259512 0.676662
H 5.915991 -3.404587 0.153104
H 6.987290 -2.117778 0.640364
H 1.295828 -1.855870 -3.733760
H 2.971081 -2.180428 -3.144736
H 1.901328 -3.554667 -3.624422


