%chk=000196947.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196947

0 1
O 7.283418 -1.313870 -0.882843
O 6.482102 3.240179 -0.543090
O 5.587514 -2.958186 -0.144491
C -3.184296 0.183253 -0.129389
C -1.995346 0.141851 0.840123
C -4.520247 0.066312 0.616797
C -0.659790 0.259081 0.093376
C -5.709209 0.107449 -0.352722
C 0.529193 0.217448 1.062861
C -7.045326 -0.009369 0.393208
C 1.862010 0.333689 0.314015
C -8.234415 0.031592 -0.576183
C 3.056051 0.282214 1.279941
C -9.570305 -0.085227 0.169705
C -10.760761 -0.044286 -0.798871
C 4.358193 0.427950 0.535083
C 5.133314 -0.673849 0.083120
C -12.093168 -0.160300 -0.061786
C 4.792553 1.737238 0.330913
C 6.413647 -0.375449 -0.498383
C 6.028357 1.974962 -0.307977
C 4.753415 -2.084484 0.131864
C 6.858812 0.941466 -0.718265
C 3.369537 -2.550753 0.451451
H -3.095211 -0.634344 -0.870642
H -3.161569 1.123180 -0.714089
H -2.020103 -0.798175 1.424534
H -2.086495 0.959547 1.581048
H -4.611033 0.884029 1.357598
H -4.544471 -0.873628 1.201301
H -0.571991 -0.557617 -0.649088
H -0.637750 1.199607 -0.490911
H -5.619607 -0.710355 -1.093596
H -5.686104 1.047196 -0.937546
H 0.438009 1.036357 1.802987
H 0.502543 -0.721106 1.649544
H -7.069388 -0.949170 0.977894
H -7.135989 0.808391 1.133931
H 1.951267 -0.484483 -0.433777
H 1.892282 1.276483 -0.267663
H -8.211027 0.971313 -1.160983
H -8.144424 -0.786290 -1.316875
H 3.034629 -0.649354 1.885137
H 2.959384 1.094494 2.033171
H -9.662219 0.731854 0.910765
H -9.595699 -1.024587 0.754712
H -10.738058 0.896183 -1.383490
H -10.671375 -0.862773 -1.539746
H 4.187716 2.573210 0.663977
H -12.164469 -1.099852 0.497850
H -12.231245 0.658062 0.653908
H -12.936346 -0.130306 -0.760880
H 7.823560 1.126542 -1.186126
H 2.618448 -2.083467 -0.209625
H 3.082182 -2.314548 1.488725
H 3.287556 -3.643138 0.329377
H 6.953630 -2.304025 -0.690758
H 5.852014 3.936156 -0.223122


%chk=000196947-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000196947

0 1
O 7.014008 -1.392930 -1.495719
O 6.817007 3.215971 -0.357181
O 5.366416 -2.993483 -0.663192
C -3.207410 0.239446 -0.119690
C -1.997399 0.198848 0.840703
C -4.566981 0.100789 0.601532
C -0.638595 0.327789 0.116004
C -5.776295 0.139082 -0.359881
C 0.572328 0.280846 1.075026
C -7.136192 -0.009040 0.358925
C 1.927854 0.396719 0.343595
C -8.344836 0.029020 -0.603550
C 3.139858 0.374651 1.319732
C -9.705227 -0.127169 0.112712
C -10.912741 -0.088200 -0.851861
C 4.480002 0.437850 0.591929
C 5.133055 -0.685931 -0.048765
C -12.268063 -0.250101 -0.130126
C 5.048768 1.719221 0.485134
C 6.345584 -0.405942 -0.825146
C 6.245011 1.944634 -0.252228
C 4.721293 -2.097897 0.030570
C 6.889979 0.894190 -0.911783
C 3.614503 -2.655555 0.910777
H -3.106825 -0.572989 -0.869652
H -3.190698 1.191593 -0.690428
H -2.018086 -0.751302 1.414734
H -2.094545 1.014636 1.587500
H -4.669290 0.913116 1.351508
H -4.583431 -0.851577 1.172074
H -0.544897 -0.486219 -0.632929
H -0.616569 1.278677 -0.456105
H -5.670747 -0.669771 -1.113135
H -5.763566 1.093643 -0.926816
H 0.483923 1.099576 1.819710
H 0.544577 -0.666981 1.653853
H -7.149140 -0.964216 0.924861
H -7.242695 0.799068 1.112883
H 2.023039 -0.422252 -0.397265
H 1.959954 1.337646 -0.241138
H -8.334946 0.986235 -1.166180
H -8.235440 -0.776011 -1.360439
H 3.060836 -0.504145 1.978981
H 3.058834 1.257911 1.981744
H -9.816870 0.676881 0.870326
H -9.717294 -1.085184 0.673929
H -10.901536 0.870461 -1.409977
H -10.797983 -0.889555 -1.610377
H 4.546101 2.564944 0.972661
H -12.317223 -1.215298 0.408731
H -12.420033 0.555557 0.613015
H -13.113747 -0.217203 -0.841642
H 7.800550 1.059070 -1.490426
H 2.625315 -2.235794 0.664322
H 3.813975 -2.459493 1.979516
H 3.589295 -3.744356 0.749996
H 6.472323 -2.282273 -1.328487
H 6.288812 3.887091 0.143135


