%chk=000216186.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216186

0 1
O 1.325089 -0.613547 -1.640736
O 3.182538 2.486270 1.435364
O 3.485899 3.267285 -0.641956
O -2.892646 -1.198785 1.026451
O -4.421894 -0.271411 -0.915146
N 0.032423 -2.389176 0.662657
N 1.774081 0.402497 0.353246
C 1.457451 -2.051124 0.322309
C 2.023353 -3.217146 -0.523585
C 1.106100 -4.418407 -0.231547
C -0.013356 -3.890022 0.693056
C 1.496244 -0.721322 -0.441371
C 1.578667 1.759106 -0.187488
C 0.360002 2.478039 0.432814
C -0.923251 1.783426 0.068475
C 2.837368 2.582024 0.105617
C -1.308748 0.628498 0.778165
C -1.721365 2.263233 -0.971140
C -2.471817 -0.046096 0.417810
C -2.910274 1.603963 -1.323163
C -3.287724 0.451005 -0.638870
H 2.018516 -1.982859 1.289077
H 3.073005 -3.427145 -0.266290
H 2.010274 -2.962744 -1.602784
H 0.688676 -4.828900 -1.167147
H 1.660608 -5.242022 0.247297
H -1.013257 -4.257433 0.395764
H 0.155346 -4.211073 1.742466
H -0.589368 -2.052932 -0.092281
H 1.455928 1.693145 -1.313997
H 1.845085 0.336259 1.367743
H 0.468173 2.536281 1.537745
H 0.343332 3.534889 0.089767
H -0.698580 0.253095 1.596911
H -1.428573 3.152094 -1.527476
H -3.523314 1.991130 -2.133352
H 4.007287 2.998052 1.655949
H -2.217803 -1.519939 1.689617
H -4.926778 0.130190 -1.667271


%chk=000216186-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216186

0 1
O 0.924316 -0.674209 -1.660664
O 3.574887 2.142208 1.107325
O 3.266944 3.536454 -0.730484
O -2.535638 -1.417994 0.779164
O -4.486404 -0.226086 -0.829006
N -0.263127 -2.574515 0.071343
N 1.724207 0.395313 0.258537
C 1.092001 -1.997908 0.379798
C 2.112875 -3.113980 -0.016323
C 1.317687 -4.455210 0.108813
C -0.154826 -4.030107 0.415763
C 1.248735 -0.699948 -0.433882
C 1.610696 1.763859 -0.256151
C 0.414893 2.549701 0.432682
C -0.929380 1.899556 0.158173
C 2.887541 2.566351 -0.045873
C -1.241348 0.643448 0.735660
C -1.868439 2.477614 -0.727234
C -2.379585 -0.106686 0.358971
C -3.075159 1.799934 -1.024051
C -3.334389 0.510270 -0.505412
H 1.140942 -1.796735 1.467585
H 3.008792 -3.092013 0.627592
H 2.437689 -2.950137 -1.058646
H 1.376800 -5.027142 -0.833080
H 1.717663 -5.097962 0.912027
H -0.907660 -4.602404 -0.150440
H -0.380281 -4.146185 1.490898
H -0.414324 -2.440948 -0.947808
H 1.412334 1.695132 -1.338801
H 2.015953 0.289526 1.232599
H 0.630480 2.593409 1.518855
H 0.434286 3.585487 0.047041
H -0.578036 0.198305 1.485033
H -1.663894 3.449619 -1.190338
H -3.806483 2.264902 -1.699538
H 4.372563 2.719567 1.249987
H -1.601118 -1.905418 0.665664
H -5.065495 0.303328 -1.433078


