%chk=000256178.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256178

0 1
O -1.850604 2.892198 -1.159482
O 1.699700 3.225096 -0.744149
O -0.257220 2.719347 2.994702
O -6.810217 -1.624531 0.109562
O 4.846779 -2.778175 1.829082
N 0.006162 1.593959 -0.543095
N -4.750559 -2.665020 0.172158
N 5.479654 -1.879266 -0.200571
C -0.200710 2.604508 0.558182
C -1.229447 1.597712 -1.379157
C 1.294009 1.922289 -1.232683
C -1.488525 3.372770 0.157000
C 1.076817 3.477006 0.537173
C -0.354682 1.827901 1.881972
C -2.159074 0.484293 -0.946013
C 2.365178 0.901866 -0.912508
C -3.540658 0.715630 -0.896219
C 2.394894 0.190321 0.293721
C -1.655155 -0.784006 -0.627047
C 3.378886 0.687064 -1.860110
C -4.419628 -0.301880 -0.530686
C 3.404163 -0.735942 0.554808
C -2.519574 -1.813895 -0.260315
C 4.398253 -0.230208 -1.616717
C -3.909867 -1.572580 -0.211075
C 4.410838 -0.949673 -0.401313
C -6.158864 -2.628326 0.309538
C 5.639793 -2.740045 0.911733
C -6.756302 -3.944547 0.724955
C 6.876255 -3.592957 0.838130
H -1.041909 1.571351 -2.477359
H 1.182926 2.077821 -2.332665
H -2.341837 3.178567 0.825081
H -1.344357 4.455988 0.017188
H 0.895643 4.562121 0.543367
H 1.794231 3.205745 1.331208
H -1.296399 1.252879 1.918836
H 0.501713 1.129443 2.031832
H -1.076593 3.243726 3.092361
H -3.926959 1.708545 -1.144628
H 1.615808 0.357330 1.047594
H -0.577765 -0.965412 -0.657372
H 3.378469 1.246379 -2.796750
H -5.497743 -0.110279 -0.494614
H 3.410181 -1.289519 1.500319
H -2.113399 -2.791458 -0.014669
H 5.174300 -0.380774 -2.362182
H -4.267163 -3.545248 0.362345
H 6.182698 -1.907471 -0.941635
H -6.393999 -4.282525 1.704731
H -7.852484 -3.843912 0.808959
H -6.567224 -4.743464 -0.004004
H 7.798633 -2.997314 0.819975
H 6.934044 -4.239729 1.730994
H 6.881091 -4.257998 -0.035189


%chk=000256178-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256178

0 1
O -1.787417 2.768362 -1.257619
O 1.523156 3.047763 -1.265491
O -0.026098 2.848904 2.870801
O -7.302298 -1.501236 -0.174284
O 5.011310 -3.518065 0.934606
N -0.000020 1.329139 -0.650744
N -5.249165 -2.441838 0.474719
N 5.882995 -1.559140 -0.026218
C -0.074799 2.401226 0.425529
C -1.285195 1.368275 -1.385065
C 1.226381 1.600925 -1.446241
C -1.430933 3.134415 0.122801
C 1.183489 3.288619 0.150600
C -0.045334 1.793458 1.841375
C -2.326926 0.382814 -0.847346
C 2.428457 0.754818 -1.015101
C -3.702564 0.623473 -1.087966
C 2.278853 -0.516660 -0.416349
C -1.958399 -0.800614 -0.165043
C 3.739144 1.228322 -1.277418
C -4.696772 -0.280880 -0.664225
C 3.392801 -1.311878 -0.073123
C -2.937555 -1.716656 0.264477
C 4.861322 0.450397 -0.941931
C -4.314468 -1.468110 0.017981
C 4.700550 -0.827067 -0.337902
C -6.643060 -2.435845 0.368419
C 6.001188 -2.816975 0.570600
C -7.330187 -3.665347 0.960959
C 7.439149 -3.298904 0.757804
H -1.120745 1.211039 -2.466528
H 1.024259 1.470058 -2.525402
H -2.224487 2.793193 0.823412
H -1.351171 4.231424 0.150456
H 0.997111 4.366325 0.258674
H 2.020995 2.987873 0.810747
H -0.903171 1.105185 1.980064
H 0.890417 1.231761 1.992493
H -0.934500 3.230363 2.969832
H -3.994858 1.543962 -1.604503
H 1.269341 -0.883381 -0.209232
H -0.899869 -0.993111 0.030850
H 3.867283 2.217594 -1.728529
H -5.754924 -0.088969 -0.848886
H 3.271342 -2.291124 0.392704
H -2.631662 -2.629230 0.793137
H 5.869321 0.835786 -1.145358
H -4.837556 -3.255410 0.937241
H 6.759228 -1.094684 -0.274477
H -8.073342 -3.334608 1.706427
H -7.882578 -4.186768 0.159970
H -6.640112 -4.381992 1.439694
H 7.613786 -3.494214 1.829843
H 7.566552 -4.258109 0.227066
H 8.203938 -2.588956 0.397002


