%chk=000258257.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258257

0 1
O 4.030227 -2.495501 2.575400
O -4.030008 2.493343 2.577655
O 7.833633 1.249441 -0.524935
O -7.833337 -1.248697 -0.526275
N 1.279038 -0.688002 -0.480332
N -1.278747 0.688731 -0.479704
N 3.020157 -2.538089 1.619104
N -3.019919 2.536836 1.621418
C 0.418869 -0.646374 0.748409
C 0.410584 -0.651614 -1.704892
C -0.418572 0.645995 0.748994
C -0.410297 0.653454 -1.704300
C 2.141155 -1.915824 -0.502543
C -2.140872 1.916566 -0.500797
C 3.234094 -1.811181 0.556408
C -3.233832 1.810928 0.558034
C 4.410508 -0.968810 0.258912
C -4.410236 0.968831 0.259726
C 4.256865 0.302812 -0.310797
C -4.256574 -0.302269 -0.311144
C 5.703982 -1.444825 0.563010
C -5.703721 1.444568 0.564215
C 5.370138 1.098559 -0.595476
C -5.369839 -1.097754 -0.596591
C 6.824964 -0.676823 0.281480
C -6.824693 0.676826 0.281942
C 6.643264 0.596961 -0.299027
C -6.642974 -0.596425 -0.299727
C 7.781445 2.578050 -1.098418
C -7.781129 -2.576780 -1.100973
H 1.083575 -0.650172 1.640745
H -0.248923 -1.530961 0.836656
H -0.275645 -1.524114 -1.773832
H 1.065298 -0.669541 -2.602164
H -1.083272 0.648989 1.641337
H 0.249221 1.530502 0.838035
H 0.275930 1.526016 -1.772452
H -1.065014 0.672193 -2.601553
H 2.635939 -1.985373 -1.499468
H 1.561661 -2.859137 -0.366768
H -2.635636 1.987040 -1.497667
H -1.561388 2.859757 -0.364132
H 3.252333 0.682421 -0.530223
H -3.252035 -0.681676 -0.530883
H 5.819705 -2.425623 1.031960
H -5.819459 2.424935 1.034063
H 5.232728 2.081018 -1.031881
H -5.232415 -2.079812 -1.033892
H 7.829991 -1.026761 0.503581
H -7.829728 1.026560 0.504329
H 3.653368 -3.078161 3.315174
H -3.653167 3.075306 3.317986
H 7.334022 2.543863 -2.095665
H 7.243998 3.258687 -0.431914
H 8.846114 2.840471 -1.153134
H -7.333671 -2.541680 -2.098172
H -7.243708 -3.258028 -0.435073
H -8.845796 -2.839149 -1.155968


%chk=000258257-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258257

0 1
O 3.673936 -3.336995 2.086384
O -3.675268 3.336440 2.089239
O 7.532852 1.548882 0.420768
O -7.530925 -1.551208 0.419671
N 1.241905 -0.745099 -0.941167
N -1.242700 0.747369 -0.940833
N 2.766367 -3.115180 0.952466
N -2.767695 3.115915 0.955077
C 0.396560 -0.656912 0.278135
C 0.400353 -0.653462 -2.160343
C -0.398636 0.656513 0.279171
C -0.399882 0.658290 -2.159332
C 2.097118 -1.964252 -0.973826
C -2.097653 1.966768 -0.971947
C 3.090709 -2.074712 0.189759
C -3.091513 2.075898 0.191510
C 4.230517 -1.132593 0.289431
C -4.230716 1.132974 0.290367
C 4.197850 0.069616 -0.476574
C -4.197053 -0.068673 -0.476479
C 5.394957 -1.377761 1.087211
C -5.395435 1.376706 1.088191
C 5.264658 0.988843 -0.461978
C -5.263133 -0.988756 -0.462580
C 6.466606 -0.472722 1.097541
C -6.466368 0.470819 1.097812
C 6.410298 0.716133 0.327454
C -6.409042 -0.717492 0.326959
C 7.519618 2.795180 -0.350320
C -7.516576 -2.797084 -0.352076
H 1.048844 -0.694165 1.167757
H -0.314678 -1.517698 0.338975
H -0.314110 -1.513178 -2.229182
H 1.056993 -0.683682 -3.050905
H -1.051891 0.691751 1.168166
H 0.312523 1.517164 0.342730
H 0.314676 1.518137 -2.225519
H -1.055586 0.690481 -3.050512
H 2.664532 -1.944317 -1.925042
H 1.481452 -2.894657 -0.962892
H -2.664836 1.948249 -1.923337
H -1.481801 2.897036 -0.959590
H 3.291212 0.294160 -1.049383
H -3.290225 -0.292086 -1.049442
H 5.450794 -2.283522 1.690459
H -5.452052 2.282017 1.692032
H 5.190299 1.904821 -1.056108
H -5.188012 -1.904262 -1.057340
H 7.359856 -0.662332 1.700777
H -7.359826 0.659323 1.701085
H 3.242397 -4.109182 2.534311
H -3.244036 4.108470 2.537733
H 7.443509 2.594973 -1.436650
H 6.687432 3.453987 -0.035160
H 8.481506 3.280018 -0.128639
H -7.440591 -2.596242 -1.438298
H -6.683836 -3.455337 -0.037222
H -8.478056 -3.282870 -0.130697


