%chk=000237816.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237816

0 1
O 5.489265 0.207207 0.290833
O 4.104065 1.989451 0.119524
O -3.393209 -3.271679 0.103651
O -1.563533 3.497738 -0.209502
O -4.931597 -1.755106 -0.054146
O -3.655674 2.938979 -0.269582
N 3.263588 -0.254429 0.222724
N 1.958726 0.034319 0.147280
N -3.772450 -2.116152 0.019133
N -2.466935 2.683817 -0.201999
C 3.903310 -1.601825 0.334309
C 5.398792 -1.252865 0.377580
C 4.243922 0.808168 0.199139
C -0.374340 -0.460179 0.075655
C -0.736150 0.897848 -0.019920
C -1.377203 -1.442400 0.087763
C 1.032875 -0.889952 0.164251
C -2.725485 -1.061882 0.004810
C -2.090163 1.247470 -0.101291
C -3.104817 0.280942 -0.090611
H 3.642932 -2.237939 -0.538137
H 3.565073 -2.126468 1.252955
H 5.896657 -1.515219 1.326462
H 5.975311 -1.627751 -0.485069
H 0.037291 1.685811 -0.031179
H -1.126756 -2.509015 0.161220
H 1.192096 -1.973044 0.238689
H -4.166790 0.571154 -0.155342


%chk=000237816-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237816

0 1
O 5.550909 0.172811 0.293684
O 4.125241 2.019261 0.105958
O -3.335501 -3.361951 0.106656
O -1.577773 3.568695 -0.210741
O -4.977215 -1.785205 -0.047574
O -3.770867 2.942344 -0.268820
N 3.307270 -0.231509 0.219677
N 1.992187 0.114256 0.139195
N -3.740927 -2.139326 0.021272
N -2.510247 2.681192 -0.198691
C 3.869042 -1.594153 0.335498
C 5.397014 -1.308076 0.385648
C 4.292817 0.802332 0.199331
C -0.349404 -0.434135 0.070027
C -0.739687 0.931525 -0.024192
C -1.349454 -1.438550 0.083403
C 1.065250 -0.824597 0.156705
C -2.706842 -1.068618 0.004728
C -2.106018 1.247587 -0.100165
C -3.123439 0.270781 -0.088183
H 3.584500 -2.210824 -0.537832
H 3.502507 -2.090964 1.253570
H 5.857587 -1.626821 1.333121
H 5.938987 -1.747231 -0.465705
H 0.017477 1.720752 -0.035777
H -1.095554 -2.500800 0.154388
H 1.280580 -1.904319 0.232175
H -4.179638 0.542543 -0.148157


