%chk=000267807.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267807

0 1
O -1.375633 -1.562164 -1.225968
O -3.626700 0.958974 -0.734601
O -3.434538 -1.339158 1.626327
O -0.352892 -3.596245 0.422678
O 4.276253 1.105059 0.503788
N -0.185997 0.416778 -0.717921
N 1.384798 2.006689 -0.145206
N 1.340763 -1.593691 -0.624041
N -0.966080 2.762048 -0.649234
N 3.603572 -1.048039 0.090300
N 2.932769 -3.319866 -0.147285
C -1.490227 -0.136526 -1.140937
C -2.614974 0.181045 -0.109481
C -3.243605 -1.198445 0.219935
C -2.160667 -2.226224 -0.191654
C -1.267840 -2.631821 0.984873
C 1.029112 -0.240716 -0.505474
C 0.101066 1.820802 -0.490412
C 1.982222 0.747030 -0.139809
C 3.373033 0.377220 0.187313
C -1.156870 3.615416 0.577963
C 2.680039 -1.926433 -0.232643
C -2.229002 4.661701 0.298212
H -1.729360 0.206017 -2.179716
H -2.243582 0.695980 0.803841
H -4.207689 -1.339690 -0.316079
H -2.552210 -3.118553 -0.730448
H -1.864284 -3.111778 1.786671
H -0.702889 -1.780224 1.403916
H -3.295466 1.891460 -0.849159
H -4.233438 -0.838911 1.911864
H 0.592022 -2.300129 -0.779919
H -0.781189 3.359125 -1.473690
H 0.315057 -3.855234 1.098102
H -1.463761 2.948873 1.413822
H -0.207557 4.106338 0.897748
H -1.920336 5.375272 -0.476425
H -3.174587 4.211841 -0.027390
H -2.441970 5.246646 1.203266
H 2.554245 -3.891273 -0.896121
H 3.913394 -3.544695 0.038094


%chk=000267807-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267807

0 1
O -1.358933 -1.607100 -1.221068
O -3.339485 1.134006 0.155244
O -3.898100 -1.761395 1.415663
O -0.359404 -3.744646 0.222060
O 4.172855 1.319695 0.739229
N -0.200413 0.430219 -0.683037
N 1.257359 2.078859 -0.043753
N 1.378395 -1.514349 -0.514744
N -1.091105 2.728001 -0.510862
N 3.626075 -0.899215 0.167510
N 3.071216 -3.137930 -0.284443
C -1.518056 -0.171729 -0.962082
C -2.493846 -0.036010 0.239682
C -3.315522 -1.337468 0.149530
C -2.267979 -2.379508 -0.310325
C -1.469955 -2.991449 0.846031
C 1.025188 -0.181225 -0.426420
C 0.006359 1.814934 -0.430706
C 1.918860 0.832197 -0.032778
C 3.310046 0.495347 0.329544
C -0.882477 4.013560 0.240505
C 2.722008 -1.794648 -0.203632
C -2.113526 4.918149 0.089059
H -1.951920 0.308369 -1.861014
H -1.904255 -0.042216 1.182214
H -4.094226 -1.203932 -0.628899
H -2.690121 -3.182674 -0.934658
H -2.133554 -3.658241 1.426712
H -1.072407 -2.208295 1.520986
H -2.692149 1.915435 0.046623
H -4.542446 -1.069899 1.711342
H 0.669452 -2.262496 -0.608695
H -1.361670 2.929002 -1.488909
H 0.132497 -4.240887 0.922892
H -0.709716 3.746585 1.296905
H 0.035292 4.520691 -0.113109
H -2.288218 5.194987 -0.968460
H -3.026548 4.428697 0.474070
H -1.962438 5.854389 0.653963
H 2.521097 -3.795355 -0.833867
H 4.046769 -3.347958 -0.083201


