%chk=000231694.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231694

0 1
O 0.681559 -0.344499 -2.513803
N -2.579385 -1.251059 0.943410
C -1.535425 -1.181065 -0.141100
C -0.147566 -1.215658 0.562370
C 0.931625 -0.312244 -0.089448
C -2.655272 -0.006378 1.766475
C -3.928710 -1.722361 0.526342
C -3.091956 1.292945 1.072674
C -4.590125 -1.109324 -0.723660
C -4.468968 1.204249 0.407042
C -4.427157 0.403863 -0.900430
C -1.655993 -2.368097 -1.107891
C 0.469485 1.140925 0.016468
C 2.290244 -0.398538 0.611449
C 1.151109 -0.860802 -1.526519
C 1.995899 -2.119316 -1.618551
C 0.505742 1.744798 1.290047
C 3.327560 0.428787 0.139440
C 0.002836 1.890753 -1.068530
C 2.542400 -1.260422 1.684982
C 1.717833 -2.897773 -2.897401
C 0.091040 3.064630 1.464863
C 4.589815 0.387557 0.730315
C -0.410553 3.216530 -0.891203
C 3.811145 -1.298391 2.276424
C -0.369021 3.808431 0.371841
C 4.836758 -0.479177 1.802010
H -1.633175 -0.231729 -0.732636
H 0.208602 -2.261895 0.615459
H -0.266529 -0.904827 1.624713
H -3.339931 -0.222990 2.616670
H -1.645246 0.150211 2.215958
H -4.610140 -1.586249 1.396987
H -3.845831 -2.824275 0.379658
H -2.329792 1.592014 0.323189
H -3.094572 2.109006 1.821310
H -5.667777 -1.363192 -0.697949
H -4.183080 -1.611925 -1.628477
H -4.833056 2.228734 0.194780
H -5.205862 0.763340 1.104119
H -5.221593 0.769482 -1.580475
H -3.471695 0.610367 -1.426017
H -0.824800 -2.388222 -1.822155
H -2.576371 -2.305390 -1.707107
H -1.670073 -3.326078 -0.577057
H 3.067560 -1.821583 -1.577469
H 1.842110 -2.767121 -0.731651
H 0.871483 1.181743 2.148676
H 3.137907 1.117324 -0.685425
H -0.045814 1.453278 -2.072501
H 1.761358 -1.909481 2.078263
H 1.776527 -2.242917 -3.779912
H 2.436595 -3.712661 -3.033954
H 0.710636 -3.333801 -2.893727
H 0.128704 3.518375 2.453510
H 5.384333 1.033804 0.359306
H -0.765977 3.785341 -1.749155
H 3.994575 -1.972041 3.112425
H -0.689221 4.838720 0.507292
H 5.821825 -0.510326 2.262935


%chk=000231694-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231694

0 1
O 0.738010 -0.354981 -2.631436
N -2.590886 -1.092666 0.848924
C -1.543817 -1.084856 -0.216221
C -0.134465 -1.159235 0.465198
C 1.025124 -0.275099 -0.158251
C -2.714452 0.147020 1.649181
C -3.861810 -1.824322 0.669211
C -3.357283 1.386508 0.966869
C -4.899993 -1.328781 -0.402657
C -4.783202 1.156361 0.414523
C -4.826578 0.170696 -0.782505
C -1.720752 -2.261044 -1.201205
C 0.603126 1.221515 -0.069109
C 2.347862 -0.446800 0.641126
C 1.268788 -0.842136 -1.597235
C 2.147003 -2.096243 -1.712235
C 0.625919 1.818557 1.223762
C 3.465919 0.344319 0.258877
C 0.179716 2.024712 -1.160346
C 2.509599 -1.351863 1.718536
C 1.984500 -2.833835 -3.052677
C 0.249353 3.162290 1.422596
C 4.704134 0.230262 0.921809
C -0.189610 3.377074 -0.961788
C 3.749641 -1.465987 2.391527
C -0.160267 3.955056 0.325229
C 4.853467 -0.680515 1.995625
H -1.595112 -0.141081 -0.808300
H 0.180275 -2.220503 0.487836
H -0.238521 -0.844975 1.518246
H -3.307354 -0.106089 2.552478
H -1.709845 0.447198 2.005134
H -4.353581 -1.798278 1.661849
H -3.645310 -2.890757 0.470000
H -2.703412 1.739800 0.144669
H -3.373515 2.205172 1.716470
H -5.915001 -1.551480 -0.011926
H -4.795291 -1.924706 -1.331644
H -5.192142 2.134165 0.089638
H -5.452539 0.793973 1.223783
H -5.704419 0.400492 -1.419558
H -3.933691 0.350816 -1.414794
H -0.927020 -2.233356 -1.965137
H -2.684102 -2.209797 -1.735083
H -1.660772 -3.230891 -0.673054
H 3.199480 -1.774758 -1.575969
H 1.946767 -2.763384 -0.851670
H 0.968322 1.229541 2.083062
H 3.352483 1.067899 -0.558003
H 0.142969 1.592892 -2.161573
H 1.673961 -1.974787 2.051314
H 2.183943 -2.155837 -3.899282
H 2.682123 -3.688325 -3.109806
H 0.955925 -3.217221 -3.177440
H 0.283484 3.591354 2.430671
H 5.549457 0.852853 0.607444
H -0.504079 3.976349 -1.824285
H 3.849185 -2.170354 3.225439
H -0.448381 5.002073 0.472953
H 5.813266 -0.770602 2.516407


