%chk=000248931.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248931

0 1
O -4.875728 1.510095 -0.406048
O -5.051625 -0.971087 -0.927346
O 5.988498 -0.485158 -0.452674
C -2.461165 0.836620 -0.187748
C -1.883843 -0.505418 0.374653
C -0.460843 -0.728283 -0.148563
C -3.926486 0.765272 0.345490
C 0.431979 0.418166 0.416626
C -2.974044 -1.541943 0.064999
C -4.295085 -0.767908 0.282501
C -1.612731 1.984416 0.380890
C -0.129604 1.799379 0.008960
C 0.125612 -2.081504 0.276094
C -2.478190 0.891789 -1.721087
C 1.879170 0.209001 0.014917
C 1.519655 -2.261235 -0.338326
C 2.359085 -1.011149 -0.290550
C -5.103736 -1.225631 1.486612
C 2.761155 1.433654 0.048747
C 3.802153 -1.252892 -0.655649
C 4.231386 1.150845 -0.020823
C 4.672258 -0.071468 -0.344053
C 7.021695 0.495075 -0.198865
H -1.819396 -0.420260 1.490700
H -0.457395 -0.673630 -1.264669
H -4.031203 1.192116 1.362040
H 0.406235 0.358690 1.537196
H -2.920661 -1.902347 -0.980790
H -2.899826 -2.435928 0.700173
H -1.722319 2.038702 1.479682
H -1.977273 2.955603 -0.003779
H 0.000243 1.943266 -1.081086
H 0.456268 2.601567 0.496207
H -0.536355 -2.906953 -0.043601
H 0.185276 -2.146975 1.378819
H -1.477135 0.732399 -2.140456
H -3.131218 0.115550 -2.144367
H -2.830677 1.866408 -2.076112
H 1.422604 -2.581734 -1.397428
H 2.043344 -3.089836 0.180249
H -4.505393 -1.217790 2.404688
H -5.976273 -0.583973 1.660739
H -5.473076 -2.249679 1.344770
H -4.873023 1.211118 -1.349343
H 2.551782 2.013496 0.974564
H 2.488324 2.097166 -0.803628
H -5.965795 -0.631758 -0.820956
H 4.197535 -2.149393 -0.127957
H 3.881206 -1.490070 -1.740616
H 4.879698 1.987245 0.200357
H 6.953925 0.857621 0.830864
H 6.952113 1.313879 -0.920550
H 7.936597 -0.090034 -0.352167


%chk=000248931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248931

0 1
O -4.914804 1.659488 -0.292705
O -5.211723 -0.905031 -0.992312
O 6.107360 -0.480295 -0.528045
C -2.480981 0.858810 -0.248940
C -1.915184 -0.494253 0.290759
C -0.463233 -0.745745 -0.153908
C -3.927015 0.787332 0.331099
C 0.425346 0.408475 0.406158
C -3.023751 -1.519946 -0.043805
C -4.348772 -0.745171 0.217527
C -1.604239 2.007142 0.302413
C -0.106196 1.800505 -0.054330
C 0.113621 -2.102982 0.295400
C -2.554458 0.934375 -1.797872
C 1.915642 0.174831 0.110233
C 1.520839 -2.302381 -0.304803
C 2.400992 -1.061689 -0.206464
C -5.114807 -1.220393 1.460592
C 2.832097 1.382924 0.257563
C 3.871118 -1.326976 -0.491515
C 4.305866 1.103906 0.054352
C 4.761787 -0.126401 -0.299067
C 7.105154 0.578083 -0.372521
H -1.890966 -0.397076 1.403056
H -0.413785 -0.716769 -1.263868
H -3.914579 1.091789 1.395152
H 0.304059 0.389976 1.517453
H -2.990629 -1.816910 -1.107418
H -2.963084 -2.440368 0.563442
H -1.706485 2.043151 1.408503
H -1.954637 2.983955 -0.083985
H 0.044145 1.910623 -1.146592
H 0.482839 2.605042 0.424628
H -0.549906 -2.932262 -0.016604
H 0.169402 -2.128337 1.403333
H -1.558948 0.857499 -2.265764
H -3.191249 0.141902 -2.228831
H -2.985413 1.908599 -2.092600
H 1.433537 -2.602083 -1.372398
H 2.032963 -3.149025 0.198052
H -4.462692 -1.191133 2.352128
H -5.983309 -0.563280 1.664154
H -5.470321 -2.260151 1.334673
H -5.179498 1.197436 -1.135461
H 2.672171 1.832296 1.264813
H 2.512829 2.177968 -0.451455
H -6.161269 -0.880434 -0.708256
H 4.240484 -2.149530 0.158602
H 3.995444 -1.710004 -1.528424
H 4.992237 1.947969 0.190255
H 7.105321 0.977490 0.661102
H 6.920885 1.408066 -1.083209
H 8.073489 0.104092 -0.591989


