%chk=000238780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238780

0 1
O 1.385778 3.521632 0.327075
O -0.373969 -2.478521 -1.028057
O -0.352409 2.570890 1.193964
O 0.956098 -3.381513 0.422569
O 5.467429 0.984344 0.079188
O 5.375404 -1.135682 -0.368452
N 0.735034 2.546094 0.652838
N 0.543249 -2.446019 -0.231536
N 4.873261 -0.060113 -0.103919
C 0.567295 0.052666 0.207109
C 1.355174 1.223153 0.370218
C 1.262698 -1.152307 -0.060103
C 3.393387 -0.020088 0.004272
C 2.750015 1.198865 0.253538
C 2.658259 -1.204022 -0.140745
C -0.880746 0.113566 0.363907
C -1.778920 -0.233299 -0.572587
C -3.230649 -0.111644 -0.376675
C -3.781937 0.979230 0.315940
C -4.076920 -1.102715 -0.905751
C -5.166402 1.073734 0.479582
C -5.458301 -1.006053 -0.729372
C -6.004652 0.081895 -0.038821
H 3.340514 2.129250 0.356052
H 3.182740 -2.160222 -0.314479
H -1.207225 0.528652 1.333942
H -1.468975 -0.635440 -1.548665
H -3.131343 1.758638 0.716895
H -3.653982 -1.952191 -1.443131
H -5.591820 1.922912 1.013646
H -6.112220 -1.778987 -1.131898
H -7.083465 0.156095 0.093455


%chk=000238780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000238780

0 1
O 1.543531 3.617548 -0.148552
O -0.172768 -2.624595 -1.158614
O -0.158336 2.837184 1.146596
O 0.888579 -3.284418 0.750395
O 5.598553 0.994108 0.117252
O 5.462573 -1.269746 -0.176644
N 0.894870 2.660598 0.421436
N 0.609790 -2.415149 -0.156370
N 4.934282 -0.103718 -0.012590
C 0.571312 0.129785 0.114681
C 1.435189 1.280684 0.247462
C 1.299005 -1.099455 -0.060963
C 3.456549 -0.021698 0.029443
C 2.836679 1.228675 0.177731
C 2.697384 -1.200450 -0.068732
C -0.883719 0.257493 0.244375
C -1.865312 -0.391447 -0.472850
C -3.308279 -0.201986 -0.290968
C -3.874692 0.688622 0.670755
C -4.190837 -0.954195 -1.122645
C -5.270269 0.814869 0.792454
C -5.588434 -0.827472 -0.998580
C -6.133511 0.058469 -0.039986
H 3.434186 2.141788 0.237182
H 3.196947 -2.170076 -0.145035
H -1.185722 1.023857 0.962533
H -1.579068 -1.080694 -1.273890
H -3.226188 1.287891 1.318697
H -3.767241 -1.644507 -1.862111
H -5.692356 1.503641 1.531960
H -6.250733 -1.414700 -1.643191
H -7.219562 0.161897 0.058769


