%chk=000238593.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238593

0 1
O -1.806831 2.450184 -1.271605
O -2.476028 2.051364 0.743951
O 4.047525 -1.301673 0.322413
N -1.774406 1.823574 -0.226544
N 2.938689 0.698252 0.026400
C -2.581461 -1.135731 -0.050965
C -1.132364 -0.625916 -0.021945
C -2.631402 -2.644673 -0.371160
C -3.404448 -0.408585 -1.131113
C -3.184910 -0.898007 1.343812
C -0.770604 0.724054 -0.119247
C -0.066145 -1.538244 0.142477
C 0.562045 1.163193 -0.114727
C 1.263572 -1.142926 0.168958
C 1.593169 0.221817 0.028103
C 4.102370 -0.099315 0.173143
C 5.379231 0.689054 0.125637
H -3.667051 -3.004757 -0.383763
H -2.200570 -2.861829 -1.354781
H -2.101196 -3.246607 0.375094
H -4.253350 -1.019307 -1.463108
H -3.849242 0.526009 -0.770061
H -2.811029 -0.185403 -2.024423
H -4.226637 -1.232342 1.388402
H -2.631498 -1.432569 2.122372
H -3.177976 0.168268 1.616488
H -0.286691 -2.604273 0.260699
H 0.783467 2.225217 -0.226944
H 2.058353 -1.890562 0.298054
H 3.050524 1.706987 -0.097180
H 5.521035 1.210045 -0.831201
H 6.241300 0.008896 0.246191
H 5.449757 1.432204 0.931674


%chk=000238593-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238593

0 1
O -1.384819 2.837378 -1.054265
O -2.657342 2.000072 0.633695
O 4.176393 -1.338777 0.337350
N -1.665772 1.920580 -0.187537
N 2.985628 0.658316 0.013632
C -2.626405 -1.140907 -0.031010
C -1.165997 -0.605068 0.027114
C -2.645397 -2.664728 -0.358832
C -3.458507 -0.441467 -1.149080
C -3.314966 -0.958793 1.358874
C -0.742795 0.755222 -0.096436
C -0.086483 -1.521885 0.168284
C 0.613037 1.148628 -0.124570
C 1.274890 -1.165094 0.189840
C 1.642767 0.195964 0.029585
C 4.163779 -0.087470 0.159118
C 5.435506 0.755912 0.083739
H -3.695978 -2.984382 -0.478740
H -2.111165 -2.894369 -1.299224
H -2.215150 -3.278480 0.453031
H -4.435111 -0.951070 -1.241307
H -3.670798 0.616342 -0.934383
H -2.947820 -0.512624 -2.127222
H -4.333262 -1.389837 1.323957
H -2.746748 -1.487932 2.146405
H -3.389862 0.103998 1.632065
H -0.317411 -2.584985 0.257969
H 0.840628 2.211336 -0.262216
H 2.052105 -1.920891 0.312891
H 3.104437 1.665066 -0.124799
H 5.520336 1.268719 -0.892320
H 6.303211 0.093303 0.210803
H 5.456266 1.524322 0.878689


