%chk=000257819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257819

0 1
O 7.677179 -1.865882 0.310633
O -7.677955 -1.854124 -0.342771
N 7.198034 0.386322 0.153486
N -7.196802 0.394649 -0.147290
C 0.750044 0.307797 0.162571
C -0.748881 0.310971 -0.157771
C 1.597553 0.316250 -1.119909
C -1.596392 0.297887 1.124668
C 3.064679 0.319309 -0.790574
C -3.063512 0.307873 0.795449
C 3.755710 -0.889013 -0.611321
C -3.755621 -0.896606 0.595619
C 3.758564 1.530494 -0.648026
C -3.756315 1.521924 0.673585
C 5.114534 -0.898733 -0.300335
C -5.114446 -0.899811 0.284528
C 5.117725 1.540883 -0.337604
C -5.115470 1.538817 0.363398
C 5.801562 0.319662 -0.162915
C -5.800391 0.321367 0.167915
C 8.056092 -0.714042 0.371960
C -8.055840 -0.701068 -0.384463
C 9.474110 -0.319222 0.685679
C -9.473502 -0.299697 -0.691405
H 1.010366 1.184897 0.786406
H 1.008948 -0.579824 0.772726
H -1.008697 1.198787 -0.766471
H -1.008290 -0.565909 -0.783061
H 1.344512 -0.563464 -1.746417
H 1.337021 1.197074 -1.740794
H -1.344068 -0.592772 1.735820
H -1.335149 1.167592 1.760741
H 3.227084 -1.836858 -0.714785
H -3.227833 -1.846545 0.682893
H 3.232900 2.475449 -0.779753
H -3.229817 2.464030 0.821402
H 5.640222 -1.850497 -0.164545
H -5.640990 -1.848648 0.132532
H 5.636451 2.489940 -0.233265
H -5.633342 2.489981 0.275265
H 7.586533 1.328077 0.222053
H -7.584461 1.337781 -0.199806
H 9.946655 0.240845 -0.131475
H 10.083510 -1.225801 0.844174
H 9.552613 0.279174 1.602411
H -9.945554 0.246800 0.135167
H -10.083711 -1.202901 -0.865307
H -9.551461 0.314288 -1.597819


%chk=000257819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257819

0 1
O 7.928406 -1.866109 0.338397
O -7.927632 -1.853527 -0.375106
N 7.289883 0.388568 0.151599
N -7.288361 0.397120 -0.146876
C 0.757065 0.218257 0.155087
C -0.756506 0.220638 -0.148484
C 1.627334 0.229666 -1.132539
C -1.627042 0.212062 1.138982
C 3.118435 0.252474 -0.833204
C -3.118006 0.240833 0.839448
C 3.851505 -0.946912 -0.646184
C -3.852016 -0.954624 0.631967
C 3.816955 1.478547 -0.682610
C -3.815300 1.469872 0.708820
C 5.224655 -0.947812 -0.320609
C -5.224853 -0.948776 0.305106
C 5.187006 1.502600 -0.357911
C -5.185068 1.500644 0.383502
C 5.904989 0.290117 -0.172200
C -5.903909 0.292085 0.176776
C 8.214427 -0.634354 0.386482
C -8.213102 -0.620976 -0.401192
C 9.620025 -0.120590 0.711640
C -9.617970 -0.100799 -0.719216
H 1.015553 1.101306 0.774899
H 1.017639 -0.673427 0.760945
H -1.014826 1.113291 -0.754479
H -1.017136 -0.661425 -0.768216
H 1.375529 -0.664129 -1.736885
H 1.349729 1.115027 -1.738639
H -1.376113 -0.691423 1.729147
H -1.348965 1.087481 1.759115
H 3.339534 -1.910676 -0.762971
H -3.341071 -1.920702 0.733097
H 3.283204 2.426377 -0.826523
H -3.280735 2.414627 0.868997
H 5.774631 -1.880341 -0.184737
H -5.775534 -1.878379 0.153001
H 5.704408 2.466321 -0.252720
H -5.701575 2.466433 0.294065
H 7.652762 1.342527 0.222601
H -7.650559 1.352415 -0.201462
H 10.030083 0.480303 -0.121676
H 10.278953 -0.984156 0.881772
H 9.616540 0.508329 1.621664
H -10.029095 0.485057 0.124218
H -10.276970 -0.960856 -0.906011
H -9.612803 0.544518 -1.617679


