%chk=000247927.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247927

0 1
O 0.283712 -2.103171 -0.799019
O -5.614173 1.005795 0.798231
O 6.096665 -0.245759 -0.474778
O -0.881426 -3.669319 0.339922
C -2.316853 0.488443 0.000038
C -1.392286 1.591857 -0.606880
C -0.005222 1.541804 0.041378
C 0.659380 0.166749 -0.256014
C 2.018535 0.050306 0.515215
C -1.742608 -0.862782 -0.445244
C -0.291197 -1.017891 0.029879
C -3.693045 0.859376 -0.637764
C -2.227239 2.876231 -0.480467
C 0.905499 2.660910 -0.485674
C -3.686162 2.409945 -0.691171
C 2.902874 1.249447 0.159413
C -2.418625 0.544374 1.530385
C 2.270750 2.614231 0.204339
C 2.714429 -1.271765 0.094206
C 1.808929 0.062775 2.039701
C -4.878870 0.305217 0.139388
C 4.192405 -1.331428 0.468184
C 4.211515 1.132679 -0.118316
C 4.948351 -0.146029 -0.096161
C -5.100515 -1.176605 0.017915
C -0.096458 -3.399448 -0.539332
C 0.605257 -4.313641 -1.481264
H -1.266008 1.384195 -1.700469
H -0.113176 1.661135 1.149852
H 0.898302 0.127301 -1.351944
H -1.782633 -0.964457 -1.547320
H -2.352289 -1.704483 -0.048862
H -0.247486 -1.351054 1.089439
H -3.740618 0.457902 -1.676262
H -1.932399 3.633461 -1.222994
H -2.102706 3.344009 0.510814
H 0.434518 3.648156 -0.315180
H 1.031808 2.574498 -1.582602
H -4.350688 2.826460 0.091834
H -4.086091 2.765009 -1.653681
H -1.433614 0.569289 2.009886
H -2.959829 1.440083 1.864584
H -2.952967 -0.322551 1.935147
H 2.171705 2.917825 1.270027
H 2.938513 3.376229 -0.250252
H 2.603799 -1.411408 -1.001802
H 2.185860 -2.130939 0.551308
H 2.767397 0.055973 2.572419
H 1.256095 0.950534 2.369017
H 1.246985 -0.816829 2.375590
H 4.648982 -2.275492 0.108138
H 4.326344 -1.345996 1.569309
H 4.829681 1.993427 -0.380916
H -5.547291 -1.434471 -0.950898
H -4.167124 -1.752460 0.113391
H -5.794177 -1.537738 0.792173
H 1.699822 -4.212185 -1.407763
H 0.342685 -4.095413 -2.528590
H 0.345880 -5.364508 -1.277300


%chk=000247927-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247927

0 1
O 0.197575 -2.219345 -0.702339
O -5.636189 0.761516 0.850115
O 6.212796 -0.099778 -0.836284
O -0.345469 -3.635113 1.075034
C -2.364655 0.493684 0.067333
C -1.428114 1.626433 -0.458462
C -0.006022 1.546764 0.127155
C 0.665311 0.165723 -0.212725
C 2.101788 0.030430 0.470001
C -1.757605 -0.840598 -0.407812
C -0.295508 -1.023728 0.074486
C -3.713056 0.920340 -0.649557
C -2.249654 2.920944 -0.253454
C 0.883808 2.694515 -0.397572
C -3.727616 2.478945 -0.522513
C 2.939510 1.267662 0.076180
C -2.545628 0.503765 1.607965
C 2.294121 2.631857 0.228109
C 2.821981 -1.265936 -0.025249
C 1.993349 -0.014686 2.029419
C -4.968475 0.245577 -0.088005
C 4.344422 -1.282435 0.226165
C 4.238968 1.182265 -0.357240
C 5.026833 -0.065025 -0.385167
C -5.384922 -1.079263 -0.715511
C 0.084031 -3.471873 -0.091243
C 0.562077 -4.559943 -1.027519
H -1.337133 1.464585 -1.557926
H -0.078379 1.660617 1.228346
H 0.839122 0.166559 -1.312330
H -1.756545 -0.873089 -1.516246
H -2.335167 -1.712693 -0.045492
H -0.289233 -1.303562 1.142631
H -3.611594 0.622145 -1.713744
H -1.932202 3.731566 -0.932463
H -2.131892 3.297554 0.780606
H 0.420099 3.670137 -0.160419
H 0.958671 2.627351 -1.502359
H -4.399425 2.770888 0.302905
H -4.126544 2.935216 -1.445842
H -1.581884 0.417910 2.139328
H -3.049303 1.420076 1.958840
H -3.170294 -0.349464 1.928305
H 2.200859 2.862854 1.311197
H 2.951443 3.408717 -0.202513
H 2.637928 -1.384742 -1.109690
H 2.374059 -2.142595 0.472704
H 2.998366 -0.069517 2.484073
H 1.494331 0.876595 2.446938
H 1.432734 -0.907500 2.360697
H 4.807063 -2.196949 -0.185474
H 4.564194 -1.279717 1.313691
H 4.778850 2.089081 -0.660998
H -5.797999 -0.890912 -1.726409
H -4.519144 -1.753269 -0.846063
H -6.157938 -1.569317 -0.103308
H 1.596356 -4.354887 -1.354689
H -0.067777 -4.584629 -1.933853
H 0.517624 -5.533903 -0.519552


