%chk=000231029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231029

0 1
O 0.511751 -2.703597 0.653768
O 3.664984 0.820729 0.455097
O 2.409245 0.384636 -1.456082
C -0.548323 -0.653773 1.018149
C 0.614596 -1.310366 0.261245
C -1.871473 -0.798540 0.257174
C -3.039218 -0.181291 1.037560
C 1.988098 -0.780112 0.704280
C -4.371724 -0.298356 0.284304
C -4.489379 0.667061 -0.903557
C 2.361021 0.501095 -0.033358
C -4.721977 2.125805 -0.483358
C -6.146472 2.382910 0.003818
C 1.134306 -3.634584 -0.246236
C 4.187706 2.108807 0.019989
C 3.331466 -0.581722 -1.997350
C 5.638904 2.090087 0.462126
H -0.328257 0.412801 1.206739
H -0.635219 -1.133236 2.016799
H 0.502357 -1.223481 -0.842367
H -2.068448 -1.873203 0.067714
H -1.792769 -0.321640 -0.739158
H -3.132131 -0.679678 2.022242
H -2.827678 0.883370 1.257731
H 2.014426 -0.603673 1.798595
H 2.764084 -1.556673 0.548526
H -5.205600 -0.116436 0.990916
H -4.507288 -1.337401 -0.073918
H -5.314472 0.335017 -1.562979
H -3.570932 0.607595 -1.520563
H 1.647153 1.342314 0.090962
H -3.999504 2.404879 0.309418
H -4.499862 2.791207 -1.340788
H -6.884272 2.168792 -0.777335
H -6.280032 3.426788 0.307243
H -6.393975 1.754233 0.867128
H 0.685076 -3.568599 -1.241433
H 2.215008 -3.470675 -0.287148
H 0.908788 -4.603390 0.216892
H 3.600694 2.897829 0.520390
H 4.073170 2.186383 -1.075994
H 3.426912 -0.272038 -3.043756
H 2.895812 -1.581107 -1.919784
H 4.294391 -0.524597 -1.477726
H 6.136831 3.040689 0.244663
H 5.718244 1.900044 1.541676
H 6.196381 1.287098 -0.037155


%chk=000231029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231029

0 1
O 0.307198 -2.669147 0.393798
O 3.809986 0.706401 0.517989
O 2.372305 0.632155 -1.430213
C -0.533317 -0.474018 0.908679
C 0.559228 -1.232501 0.135273
C -1.957112 -0.717322 0.364358
C -3.040704 0.001607 1.199831
C 1.992200 -0.848288 0.577351
C -4.493556 -0.319067 0.768123
C -4.858054 0.082667 -0.685476
C 2.452270 0.511088 0.033862
C -4.691242 1.588401 -1.014501
C -5.570095 2.520002 -0.149403
C 0.901767 -3.561621 -0.595481
C 4.315495 2.085713 0.325759
C 3.178285 -0.349805 -2.171339
C 5.745155 2.122494 0.862433
H -0.306564 0.611255 0.882472
H -0.480851 -0.790503 1.970221
H 0.446452 -1.035784 -0.956033
H -2.151069 -1.807147 0.357515
H -2.005348 -0.376054 -0.690169
H -2.918469 -0.289892 2.263820
H -2.868758 1.097540 1.162892
H 2.042767 -0.813363 1.680571
H 2.716774 -1.616310 0.249398
H -5.194046 0.177181 1.469451
H -4.664459 -1.409447 0.882978
H -5.912810 -0.206518 -0.874504
H -4.244868 -0.508887 -1.394641
H 1.796517 1.341875 0.365964
H -3.627520 1.879955 -0.904710
H -4.942272 1.744405 -2.083049
H -6.638064 2.240176 -0.227961
H -5.471884 3.573358 -0.471329
H -5.288315 2.469926 0.918375
H 0.563933 -3.309100 -1.624267
H 2.012633 -3.546751 -0.572347
H 0.556707 -4.576045 -0.337967
H 3.658611 2.790870 0.879797
H 4.273404 2.346883 -0.749985
H 3.210451 0.019594 -3.208349
H 2.713168 -1.356166 -2.158254
H 4.203164 -0.413311 -1.760101
H 6.170067 3.137497 0.756695
H 5.766904 1.842475 1.929784
H 6.386333 1.415528 0.307790


