%chk=000270597.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270597

0 1
O -1.344815 2.951285 -1.970030
O 4.115674 1.095818 1.414318
O -3.174486 3.617580 0.126773
O 5.476330 -0.326947 -0.759074
O -2.267240 -3.711209 -0.265960
O -2.665806 -2.366505 1.509205
C -0.054372 -1.112380 0.212709
C -0.895723 0.105012 0.225219
C 1.394310 -0.882650 -0.034067
C -0.786092 1.016111 -0.841277
C 2.110090 -0.023405 0.812601
C -1.775442 0.367137 1.279344
C 2.040907 -1.529877 -1.098901
C -1.563833 2.177205 -0.852163
C 3.473453 0.184886 0.583950
C -0.504095 -2.366536 0.388668
C -2.456137 2.439302 0.227145
C 4.116613 -0.442352 -0.508092
C -2.551212 1.533299 1.283111
C 3.396837 -1.305314 -1.343651
C -1.903586 -2.746025 0.648023
C -2.085426 4.190409 -2.096844
C 5.183807 0.510371 2.210591
C -3.612408 -4.275989 -0.169104
C -4.114861 3.916185 1.187807
C 5.917366 1.030682 -1.043030
C -3.666118 -5.289451 0.955525
H -0.100940 0.832174 -1.670184
H 1.621340 0.486537 1.644260
H -1.878206 -0.347635 2.102459
H 1.478631 -2.201276 -1.749068
H 0.174292 -3.226134 0.336788
H -3.228078 1.710973 2.115264
H 3.908188 -1.790142 -2.174889
H -1.711401 4.578286 -3.050909
H -1.843978 4.859866 -1.264514
H -3.160034 3.983571 -2.136477
H 5.618282 1.390598 2.696128
H 4.750960 -0.175231 2.944113
H 5.911065 0.000380 1.568818
H -3.718806 -4.729153 -1.171572
H -4.332273 -3.449689 -0.031377
H -3.589204 4.034253 2.139758
H -4.887808 3.143812 1.240868
H -4.535050 4.871396 0.848716
H 7.006157 0.918111 -1.071756
H 5.522014 1.336980 -2.015436
H 5.600576 1.719040 -0.250864
H -4.616099 -5.835679 0.959203
H -2.855386 -6.024504 0.874475
H -3.562378 -4.798273 1.935098


%chk=000270597-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270597

0 1
O -0.966790 3.607334 -1.298690
O 4.099406 1.300479 1.118136
O -3.044500 3.860765 0.616820
O 5.571692 -0.488010 -0.685239
O -2.016874 -4.212789 -0.103689
O -3.098659 -2.140864 0.022692
C -0.121923 -1.051896 0.018307
C -0.925634 0.190540 0.187789
C 1.354234 -0.888970 -0.169919
C -0.644407 1.329845 -0.617585
C 2.062507 0.133270 0.519145
C -1.959900 0.296385 1.151474
C 2.094205 -1.767334 -1.012211
C -1.369042 2.528049 -0.490297
C 3.456671 0.271292 0.387971
C -0.624486 -2.341900 0.031507
C -2.395191 2.622801 0.501864
C 4.177993 -0.586697 -0.494460
C -2.677228 1.496634 1.313223
C 3.483918 -1.612048 -1.174669
C -2.023914 -2.796467 0.000433
C -2.006711 4.262550 -2.119319
C 5.055607 0.815663 2.141406
C -3.350823 -4.871336 -0.162723
C -4.066893 3.996714 1.659329
C 6.049893 0.816354 -1.206827
C -3.889728 -5.140819 1.246804
H 0.142992 1.300732 -1.376985
H 1.540583 0.819040 1.193368
H -2.201831 -0.560877 1.783369
H 1.568608 -2.542584 -1.579160
H 0.088423 -3.172252 0.002389
H -3.456580 1.548799 2.079015
H 4.053669 -2.260366 -1.847799
H -1.469143 5.031302 -2.695239
H -2.780058 4.724861 -1.484069
H -2.469282 3.530997 -2.810384
H 5.483222 1.722638 2.594961
H 4.521479 0.225751 2.910085
H 5.851032 0.199419 1.683589
H -3.158691 -5.806246 -0.714197
H -4.041199 -4.225883 -0.734365
H -3.635348 3.828659 2.664489
H -4.907579 3.296603 1.491550
H -4.422641 5.034054 1.576038
H 7.147243 0.736709 -1.224444
H 5.665845 0.972482 -2.232325
H 5.726748 1.647169 -0.555426
H -4.836194 -5.710116 1.185219
H -3.167874 -5.732202 1.836509
H -4.091251 -4.193331 1.774240


