%chk=000216200.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216200

0 1
O 0.483278 -3.419039 0.879713
O -3.164194 -1.823538 -0.929114
O -4.112345 -2.001288 1.090629
O 0.131589 3.651011 -0.710469
O 2.799514 1.092478 2.404815
O -2.402764 4.314793 -1.449535
O 2.820427 2.971321 0.423810
N -0.697473 -1.753899 -0.134767
N 0.948469 -4.193909 -1.912036
C -1.678716 -1.661297 0.959333
C 1.170201 -2.828910 -1.379772
C -1.589633 -0.321887 1.720141
C 2.637813 -2.511146 -1.003320
C 0.301389 -2.724240 -0.107996
C -1.789554 0.897752 0.863211
C 2.774784 -1.070179 -0.604182
C -3.106878 -1.850798 0.439816
C -0.671917 1.664479 0.481435
C -3.076009 1.288143 0.474913
C 2.769347 -0.725738 0.759063
C 2.859780 -0.073051 -1.586625
C -0.867384 2.810656 -0.282188
C -3.276280 2.433641 -0.306083
C 2.820604 0.620697 1.110971
C 2.904997 1.279563 -1.234803
C -2.173952 3.198266 -0.687247
C 2.866597 1.627556 0.116268
H -1.481587 -2.505855 1.695976
H 0.829701 -2.105316 -2.169129
H -0.601513 -0.278721 2.228445
H -2.338926 -0.329365 2.545084
H 3.304844 -2.743225 -1.857954
H 2.968679 -3.185289 -0.182802
H -0.879382 -1.170639 -0.951562
H 1.130096 -4.903529 -1.202462
H 1.555549 -4.381356 -2.703915
H 0.328529 1.366697 0.785205
H -3.944018 0.705312 0.785998
H 2.705341 -1.501615 1.521259
H 2.884188 -0.346417 -2.641222
H -4.275185 2.740823 -0.613626
H 2.961151 2.061689 -1.992816
H -4.089243 -1.952271 -1.278194
H 1.027329 3.402355 -0.324844
H 2.836621 0.353638 3.064343
H -1.544690 4.791872 -1.638259
H 2.933929 3.110276 1.408395


%chk=000216200-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216200

0 1
O 0.628974 -3.232943 1.080732
O -3.179258 -1.749537 -1.224329
O -4.232572 -1.941710 0.837029
O 0.149943 3.751121 -0.562914
O 2.949304 1.272281 2.307973
O -2.315146 4.568340 -1.154891
O 2.625348 3.033266 0.314275
N -0.739197 -1.903958 -0.255371
N 1.077930 -4.397154 -1.601130
C -1.778352 -1.748597 0.767714
C 1.257300 -2.973440 -1.275338
C -1.663690 -0.435649 1.630602
C 2.744408 -2.567587 -0.962264
C 0.362605 -2.701412 -0.046977
C -1.845497 0.876928 0.881196
C 2.876057 -1.092024 -0.638201
C -3.180301 -1.841356 0.172502
C -0.712105 1.652086 0.514378
C -3.139356 1.367903 0.565691
C 2.948483 -0.662682 0.712792
C 2.813213 -0.116617 -1.667478
C -0.873088 2.880710 -0.156799
C -3.305930 2.592980 -0.121213
C 2.919109 0.710448 1.012213
C 2.772456 1.263125 -1.366470
C -2.177287 3.347442 -0.487095
C 2.802672 1.667012 -0.023397
H -1.658625 -2.593355 1.473851
H 0.907040 -2.370301 -2.135863
H -0.668992 -0.474861 2.109758
H -2.422556 -0.529844 2.429999
H 3.350500 -2.835639 -1.849337
H 3.081508 -3.193349 -0.115917
H -0.938664 -1.539633 -1.189070
H 1.211138 -5.016211 -0.794878
H 1.565437 -4.714056 -2.443441
H 0.290262 1.286515 0.758166
H -4.026450 0.804039 0.876363
H 2.980046 -1.409359 1.516168
H 2.781254 -0.437165 -2.715042
H -4.299860 2.981832 -0.361912
H 2.694718 2.020379 -2.152039
H -4.115260 -1.756165 -1.561150
H 1.072335 3.508897 -0.231387
H 2.998695 0.584960 3.014226
H -1.398674 4.934079 -1.292971
H 2.803230 3.150761 1.285148


