%chk=000148602.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000148602

0 1
O 0.695992 0.222876 0.991838
O 0.190593 -1.640135 -0.190028
O 4.373212 1.884037 -0.469068
O 5.120637 0.031191 0.551322
O -3.818835 1.728211 -1.005171
N -3.915580 -0.324876 -0.286760
N 2.894673 -0.996439 -1.211560
N -4.487356 0.855555 -0.517308
C -1.563726 -0.057318 0.469940
C 2.786449 0.140596 -0.272200
C -2.496644 -0.658923 -0.592030
C 2.094759 -0.160332 1.074295
C -0.182204 -0.623295 0.348338
C 4.216332 0.606382 -0.002062
C -4.741518 -1.380776 0.346259
H -1.947155 -0.245341 1.498272
H -1.543964 1.056715 0.382067
H 2.220937 0.972329 -0.791087
H -2.239713 -0.246257 -1.598250
H -2.361482 -1.762001 -0.655385
H 2.171036 -1.222185 1.368151
H 2.445704 0.488538 1.900771
H 1.965676 -1.313397 -1.498073
H 3.365779 -1.791003 -0.781257
H -4.851843 -2.244772 -0.332262
H -5.755827 -1.002900 0.576626
H -4.283473 -1.722185 1.289665
H 5.301044 2.229707 -0.353144


%chk=000148602-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148602

0 1
O 0.667609 0.386587 0.967298
O 0.200325 -1.786518 0.232054
O 4.840118 1.073744 0.989149
O 5.049216 -0.390239 -0.807608
O -3.512470 0.531962 -2.192972
N -3.919450 -0.684903 -0.352610
N 2.223423 -0.047721 -1.428609
N -4.403118 0.162907 -1.334106
C -1.563905 -0.056687 0.235310
C 2.806745 0.564002 -0.246998
C -2.512144 -1.136739 -0.332813
C 2.106645 0.063282 1.047484
C -0.167452 -0.609550 0.446783
C 4.331020 0.335776 -0.092033
C -4.890362 -1.117191 0.658424
H -1.936074 0.341411 1.198288
H -1.504698 0.799019 -0.460212
H 2.654653 1.658919 -0.297012
H -2.213100 -1.371819 -1.369799
H -2.454101 -2.060925 0.265101
H 2.231931 -1.028587 1.167666
H 2.487939 0.601202 1.926781
H 2.293055 -1.068262 -1.470096
H 2.456978 0.404992 -2.314656
H -5.017797 -2.215362 0.641217
H -5.852530 -0.635192 0.423079
H -4.570557 -0.814577 1.673021
H 5.821604 0.924469 1.069767


