%chk=000180982.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180982

0 1
O 1.095711 -3.090269 -0.016346
O 0.655232 -2.088943 -1.998112
O -3.336718 1.816272 1.716059
O 2.614839 2.132191 0.070440
C -1.176879 -2.862284 -0.558316
C -1.991912 -3.864522 -1.371726
C -1.541923 -4.227069 0.022590
C -1.780259 -1.618939 -0.005383
C 0.244582 -2.612978 -0.992062
C -1.416439 -1.199439 1.291961
C -2.682370 -0.860382 -0.757132
C -1.955087 -0.042231 1.831845
C -3.245065 0.308017 -0.230526
C -2.875750 0.705247 1.060831
C 2.524595 -2.833759 -0.168723
C 2.853122 -1.540534 0.529203
C 2.520814 -0.326100 -0.086732
C 3.483023 -1.555066 1.779916
C -4.254182 2.713442 1.007324
C 2.824065 0.858991 0.587724
C 3.788464 -0.348921 2.425326
C 3.460178 0.872514 1.842334
C -4.501629 3.815343 2.017762
C 1.629074 2.340024 -0.902687
C 0.359773 1.756465 -0.841538
C 1.990196 3.274896 -1.883194
C -0.573700 2.121102 -1.815507
C 1.033081 3.627935 -2.835844
C -0.242754 3.051134 -2.807268
H -3.044224 -3.656740 -1.562156
H -1.536428 -4.346258 -2.236184
H -0.755059 -4.966490 0.169486
H -2.269114 -4.272306 0.832615
H -0.699099 -1.792434 1.864910
H -2.950169 -1.175814 -1.766678
H -1.689407 0.305264 2.828168
H -3.953893 0.876555 -0.821215
H 2.967386 -3.724705 0.313200
H 2.787065 -2.811683 -1.245091
H 2.041762 -0.317525 -1.069458
H 3.732718 -2.498930 2.258530
H -5.167126 2.147298 0.756398
H -3.751162 3.074616 0.093974
H 4.282716 -0.367104 3.397008
H 3.682508 1.820807 2.326080
H -5.183897 4.575988 1.622188
H -4.934465 3.416410 2.946116
H -3.562931 4.313298 2.301422
H 0.100908 1.043938 -0.059008
H 2.989064 3.704120 -1.885401
H -1.566925 1.670498 -1.797063
H 1.285232 4.352564 -3.609473
H -0.976744 3.324598 -3.561391


%chk=000180982-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180982

0 1
O 1.100593 -3.167251 0.027274
O 0.505355 -2.183937 -2.007409
O -3.451707 1.794558 1.793842
O 2.855967 2.179269 -0.041063
C -1.246239 -3.008940 -0.481191
C -2.078752 -3.991897 -1.313337
C -1.596098 -4.387077 0.092911
C -1.878327 -1.758230 0.090977
C 0.176315 -2.745695 -0.936836
C -1.546758 -1.335502 1.407454
C -2.755290 -0.957244 -0.674783
C -2.084205 -0.152794 1.943065
C -3.310753 0.232448 -0.149912
C -2.971018 0.637430 1.166139
C 2.550914 -2.831553 -0.237532
C 2.930929 -1.549413 0.467763
C 2.676543 -0.301767 -0.155671
C 3.533258 -1.589160 1.749967
C -4.338853 2.684404 1.017451
C 3.006669 0.891709 0.524228
C 3.876566 -0.386196 2.407725
C 3.612353 0.859240 1.801463
C -4.681531 3.864092 1.923014
C 1.822820 2.470961 -0.972413
C 0.524260 1.919066 -0.881447
C 2.139644 3.439066 -1.950458
C -0.459173 2.337079 -1.805489
C 1.142899 3.852813 -2.860670
C -0.158192 3.299962 -2.796530
H -3.140986 -3.765891 -1.444879
H -1.604405 -4.468371 -2.176171
H -0.794077 -5.125138 0.176446
H -2.337954 -4.419724 0.896186
H -0.857349 -1.940738 2.007061
H -3.003403 -1.262335 -1.697570
H -1.835835 0.181742 2.954894
H -3.998078 0.821827 -0.764292
H 3.088820 -3.700822 0.171431
H 2.687436 -2.762503 -1.330323
H 2.226538 -0.274615 -1.153569
H 3.729165 -2.555212 2.229201
H -5.250762 2.126962 0.719050
H -3.811310 3.020216 0.100736
H 4.347606 -0.416112 3.396083
H 3.866527 1.804021 2.290938
H -5.349636 4.567656 1.393787
H -5.191604 3.517181 2.837767
H -3.766740 4.404863 2.219022
H 0.276009 1.185231 -0.108377
H 3.153330 3.849710 -1.981569
H -1.460391 1.897808 -1.741952
H 1.386029 4.602021 -3.622231
H -0.926320 3.614885 -3.511007


