%chk=000222178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222178

0 1
O -1.023279 1.650090 -0.459978
O -2.179773 -1.737514 0.338320
O -10.908652 0.482185 0.326274
O 10.216432 -0.215851 -0.505367
O 9.306408 0.681179 1.329226
C -0.954913 0.345284 0.132290
C -2.250796 -0.430235 -0.248904
C 0.297595 -0.416325 -0.310678
C -3.503072 0.328116 0.199661
C 1.574550 0.245566 0.216902
C -4.780792 -0.336310 -0.322951
C 2.831437 -0.454683 -0.314886
C -6.036537 0.357235 0.219796
C 4.107244 0.204931 0.225489
C 5.366156 -0.492412 -0.307600
C -7.314377 -0.307908 -0.309588
C 6.636971 0.167895 0.239363
C -8.565667 0.383308 0.239042
C 7.895597 -0.521222 -0.299158
C -9.841629 -0.276116 -0.285137
C 9.134318 0.062328 0.307217
H -0.934428 0.582171 1.220107
H -2.273237 -0.662763 -1.337491
H 0.332100 -0.491806 -1.414107
H 0.223980 -1.466307 0.048623
H -3.433690 1.378786 -0.158637
H -3.533539 0.403129 1.303404
H 1.581846 1.317341 -0.069051
H 1.575699 0.234179 1.324366
H -4.782288 -1.409041 -0.040773
H -4.788663 -0.319940 -1.430177
H 2.812433 -1.525848 -0.034337
H 2.836119 -0.433430 -1.421745
H -6.026449 1.429161 -0.059132
H -6.032969 0.335975 1.326937
H 4.103350 0.181500 1.332923
H 4.123029 1.277245 -0.051392
H 5.370300 -0.465538 -1.414710
H 5.346242 -1.564723 -0.031162
H -7.320506 -0.280072 -1.416791
H -7.321044 -1.380336 -0.032463
H 6.640080 0.138510 1.349398
H 6.654282 1.244174 -0.026168
H -8.575096 0.365014 1.347823
H -8.574252 1.459289 -0.029287
H -0.806314 1.617476 -1.411908
H -2.398387 -1.708757 1.290185
H 7.871313 -1.612823 -0.081319
H 7.944458 -0.451800 -1.408676
H -9.930588 -1.330697 0.028354
H -9.935048 -0.200706 -1.382306
H -11.772851 0.133415 0.043850
H 11.071096 0.137182 -0.143171


%chk=000222178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222178

0 1
O -1.048233 1.715921 -0.510616
O -2.194743 -1.784738 0.392572
O -11.110152 0.466833 0.332803
O 10.425775 -0.596948 -0.289530
O 9.427446 1.031897 1.028420
C -0.973933 0.366486 0.101849
C -2.270132 -0.432968 -0.215015
C 0.305662 -0.371466 -0.331918
C -3.549201 0.302740 0.224102
C 1.600294 0.283107 0.195976
C -4.844255 -0.349164 -0.306248
C 2.879551 -0.398975 -0.337948
C -6.122792 0.317686 0.247757
C 4.179734 0.228111 0.212928
C 5.459274 -0.456449 -0.317960
C -7.423771 -0.304566 -0.307587
C 6.754086 0.175352 0.238028
C -8.696569 0.361405 0.262380
C 8.017912 -0.523628 -0.297501
C -9.984488 -0.252917 -0.291088
C 9.305233 0.074716 0.233601
H -0.940388 0.585753 1.187923
H -2.305420 -0.648164 -1.301932
H 0.331635 -0.413397 -1.444111
H 0.235894 -1.420602 0.013261
H -3.480133 1.354025 -0.114428
H -3.574179 0.337742 1.336546
H 1.607394 1.357635 -0.075385
H 1.600977 0.242235 1.305336
H -4.844332 -1.427939 -0.051694
H -4.852041 -0.290242 -1.414868
H 2.856173 -1.479073 -0.081562
H 2.888512 -0.344323 -1.447121
H -6.106920 1.402309 0.012499
H -6.126510 0.241193 1.355330
H 4.170338 0.176618 1.321625
H 4.205616 1.306771 -0.046882
H 5.467218 -0.405016 -1.427196
H 5.430330 -1.535348 -0.056735
H -7.422799 -0.221018 -1.414879
H -7.434742 -1.390551 -0.076645
H 6.750185 0.130172 1.343994
H 6.790231 1.250486 -0.022611
H -8.710035 0.270623 1.365984
H -8.694505 1.444014 0.029424
H -0.903725 1.614226 -1.487119
H -2.344451 -1.686930 1.368671
H 8.015828 -1.601774 -0.041591
H 8.057909 -0.483443 -1.404076
H -10.025290 -1.337220 -0.045307
H -10.013006 -0.145042 -1.398049
H -11.965021 0.094419 -0.000904
H 11.252760 -0.181075 0.077995


