%chk=000188549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188549

0 1
O -0.776392 1.904091 0.504742
O 2.883246 -2.237848 -0.374339
O -1.289210 2.319226 -1.678963
N 3.689061 0.570176 0.047064
C 2.397082 0.037179 -0.002209
C 1.480875 1.126256 0.194731
C 0.088582 0.844298 0.187752
C -0.388384 -0.437520 -0.011471
C 1.896190 -1.285724 -0.200547
C 2.255996 2.310890 0.364404
C 0.536959 -1.513051 -0.200177
C 3.598061 1.949697 0.269395
C -1.833802 -0.753576 -0.037380
C 4.940226 -0.175914 -0.108608
C -2.423661 -1.425444 1.044150
C -2.610610 -0.399224 -1.151044
C -3.784694 -1.740421 1.007945
C -3.969416 -0.720926 -1.181341
C 2.456182 -3.598210 -0.632451
C -4.558165 -1.391537 -0.103916
C -1.425178 2.592812 -0.515074
C -2.256848 3.650113 0.123696
H 1.862006 3.292427 0.534765
H 0.124827 -2.507035 -0.350827
H 4.470907 2.574029 0.343927
H 5.520670 0.202409 -0.968755
H 5.561765 -0.098587 0.800989
H 4.735068 -1.252842 -0.287544
H -1.820216 -1.692504 1.909837
H -2.147749 0.134456 -1.986029
H -4.242986 -2.258249 1.848263
H -4.570174 -0.448110 -2.047267
H 1.896394 -3.986881 0.223540
H 3.415026 -4.118137 -0.747354
H 1.870097 -3.642521 -1.555694
H -5.616540 -1.640726 -0.130573
H -3.328124 3.444222 -0.032241
H -2.042094 4.635709 -0.316380
H -2.088777 3.716597 1.211485


%chk=000188549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188549

0 1
O -0.856889 1.911418 0.424025
O 2.904835 -2.308136 -0.277711
O -0.838641 2.753654 -1.766853
N 3.670736 0.592187 0.030753
C 2.382140 0.039349 -0.014616
C 1.440686 1.117289 0.124977
C 0.050002 0.839022 0.118740
C -0.422781 -0.477867 -0.021960
C 1.924931 -1.301493 -0.149044
C 2.200879 2.334825 0.264880
C 0.538676 -1.536042 -0.145222
C 3.545405 1.978648 0.199470
C -1.875859 -0.823885 -0.038606
C 4.961841 -0.103872 -0.088336
C -2.369587 -1.876571 0.778903
C -2.788708 -0.146722 -0.892386
C -3.735120 -2.235708 0.754075
C -4.153960 -0.505572 -0.917997
C 2.433248 -3.686673 -0.428084
C -4.635317 -1.549484 -0.093486
C -1.216228 2.837806 -0.582495
C -2.127206 3.887677 0.012254
H 1.806122 3.340271 0.389741
H 0.153605 -2.550708 -0.278245
H 4.434617 2.604879 0.256878
H 5.519617 0.265979 -0.968000
H 5.573373 0.060542 0.817545
H 4.778598 -1.179645 -0.206927
H -1.681160 -2.395816 1.456091
H -2.417693 0.633222 -1.566180
H -4.097118 -3.043913 1.399983
H -4.839403 0.021552 -1.591568
H 1.846267 -4.006491 0.454415
H 3.344883 -4.296972 -0.510088
H 1.821425 -3.801873 -1.343272
H -5.695336 -1.826731 -0.114492
H -3.061977 3.410884 0.357358
H -2.357926 4.652767 -0.742554
H -1.654778 4.351803 0.894534


