%chk=000193323.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193323

0 1
O -1.169445 -1.686631 0.620439
O -4.050971 -0.701014 -1.218778
O -3.640695 -3.182953 -0.138625
O -2.897767 3.403660 -3.296124
O 0.025589 -0.406573 2.469596
O -0.817380 4.651639 -1.700099
O 7.407877 -0.115669 1.444431
C -1.848577 -1.593021 -0.669357
C -2.900124 -0.475718 -0.397178
C -2.352434 0.886326 -0.754921
C -2.481854 -2.962010 -0.956486
C -2.841762 1.582333 -1.863083
C -1.346338 1.440627 0.050462
C 0.205274 -1.822108 0.611122
C -2.323045 2.848900 -2.177141
C -0.823057 2.697795 -0.252574
C 0.871424 -1.155075 1.684336
C -1.307337 3.402015 -1.361494
C 0.931252 -2.592199 -0.290217
C 2.246369 -1.292165 1.844045
C 2.976109 -2.077482 0.925897
C 2.319621 -2.719198 -0.128621
C 4.433428 -2.233150 1.075401
C -2.462862 4.729799 -3.691068
C 0.598109 0.237039 3.635667
C 5.259140 -1.217133 1.345396
C 6.739150 -1.383372 1.514667
H -1.139118 -1.301291 -1.471277
H -3.206581 -0.511350 0.677333
H -2.890526 -3.010877 -1.986529
H -1.762393 -3.783430 -0.790273
H -3.634938 1.153459 -2.484241
H -0.968058 0.881824 0.914037
H -4.542092 -1.502622 -0.887508
H -0.043001 3.128417 0.369158
H 0.435601 -3.101659 -1.113129
H 2.768753 -0.805010 2.662893
H -3.375939 -3.182226 0.811435
H 2.882355 -3.322836 -0.838493
H 4.799917 -3.254373 0.940492
H -0.124558 4.943571 -1.058377
H -1.396128 4.716890 -3.937383
H -2.670346 5.447884 -2.891305
H -3.083169 4.914615 -4.574918
H 4.904428 -0.191274 1.472879
H 1.344985 0.976700 3.335292
H 1.012110 -0.509521 4.319441
H -0.285159 0.722063 4.073069
H 7.187138 -2.069405 0.771843
H 6.994780 -1.733514 2.537878
H 7.289945 0.284007 0.558989


%chk=000193323-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193323

0 1
O -0.769556 -0.872003 0.629604
O -4.002854 -0.565485 -0.978151
O -3.008828 -2.794788 0.380380
O -3.611837 3.239715 -4.039115
O 0.388835 -0.784149 2.984527
O -1.556931 4.988091 -3.015560
O 7.877671 -1.628494 2.618750
C -1.573470 -1.038100 -0.611971
C -2.764105 -0.027464 -0.422684
C -2.470199 1.315480 -1.078999
C -2.048671 -2.495465 -0.702063
C -3.182189 1.730994 -2.224997
C -1.460014 2.154618 -0.548719
C 0.576500 -1.267097 0.647941
C -2.897191 2.959216 -2.861834
C -1.163387 3.381698 -1.177902
C 1.213661 -1.200703 1.932253
C -1.862174 3.786304 -2.338307
C 1.325711 -1.691883 -0.468483
C 2.570258 -1.547220 2.061707
C 3.335221 -1.968520 0.933380
C 2.688354 -2.034715 -0.324971
C 4.759010 -2.336593 1.027651
C -4.212978 4.582400 -4.178925
C 0.996816 -0.681662 4.314004
C 5.552692 -2.335385 2.139498
C 7.008715 -2.722457 2.121392
H -0.976324 -0.766471 -1.501860
H -2.861278 0.110094 0.675246
H -2.604924 -2.658101 -1.637773
H -1.190456 -3.193679 -0.659282
H -3.981107 1.103826 -2.627290
H -0.909370 1.851860 0.348551
H -4.216933 -1.382755 -0.445807
H -0.375264 4.029035 -0.769155
H 0.864013 -1.753193 -1.457865
H 3.048747 -1.497286 3.043734
H -2.568222 -2.580445 1.243650
H 3.254580 -2.358933 -1.205684
H 5.217884 -2.652459 0.077402
H -0.790394 5.437570 -2.580781
H -3.438510 5.366190 -4.195041
H -4.926143 4.771918 -3.353165
H -4.753454 4.549142 -5.137249
H 5.162423 -2.023537 3.118258
H 1.826137 0.052128 4.321484
H 1.366870 -1.664631 4.665513
H 0.186725 -0.333323 4.970902
H 7.315100 -3.040360 1.102096
H 7.219492 -3.548240 2.823410
H 7.669049 -0.809980 2.099300


