%chk=000189739.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189739

0 1
P 2.769796 2.154066 -1.188286
P 3.719197 -0.578931 -0.074561
P 1.364475 -1.283952 1.760011
O -2.199672 1.848422 -1.174307
O -1.971024 1.420032 2.248709
O -1.780274 4.464144 0.620146
O 1.298991 2.668737 -0.743050
O -4.581565 -0.105098 1.709220
O 3.009689 0.900319 -0.132763
O -1.450499 -3.437141 1.675164
O 2.421688 1.311896 -2.556131
O 3.834717 3.142382 -1.210918
O 2.439581 -1.411986 0.527545
O 4.673263 -0.394089 1.219894
O 4.283811 -1.101760 -1.303314
O 1.124440 -2.812812 2.165687
O 2.393350 -0.827884 2.959774
O 0.249208 -0.371390 1.472856
N -2.879460 -0.006472 0.124591
N -3.071339 -1.852898 1.661217
C -2.414060 2.256916 1.210069
C -1.264763 3.133517 0.646856
C -2.979122 1.483339 -0.032261
C -1.034059 2.638440 -0.796775
C 0.196106 1.729904 -0.926428
C -1.962218 -0.747814 -0.635685
C -3.592102 -0.600535 1.223074
C -1.551234 -1.985928 -0.247553
C -0.664655 -2.863430 -1.081206
C -1.970093 -2.509865 1.050988
C 0.413771 -2.096521 -1.864615
C 1.624800 -2.976106 -2.157706
H -3.208219 2.879613 1.694177
H -0.347968 3.084457 1.274161
H -4.033954 1.746373 -0.291370
H -1.026170 3.469012 -1.537901
H 0.247023 0.963487 -0.119097
H 0.233863 1.252224 -1.926397
H -1.169375 0.876447 1.987684
H -1.045286 5.116436 0.633860
H -1.618826 -0.266001 -1.565196
H -3.472110 -2.250698 2.524178
H -0.185608 -3.632221 -0.433646
H -1.293720 -3.448542 -1.787101
H -0.010042 -1.716623 -2.814969
H 0.738494 -1.200450 -1.302098
H 2.085842 -3.354013 -1.235286
H 2.408866 -2.415215 -2.685923
H 1.365718 -3.841003 -2.777122
H 3.164188 1.006339 -3.140840
H 4.282516 0.058289 2.032132
H 0.235008 -3.303020 1.884960
H 2.672313 -1.537094 3.606852


%chk=000189739-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189739

0 1
P 2.966389 2.450085 -1.047621
P 3.743190 -0.334123 0.175137
P 1.404651 -1.361477 2.024484
O -2.202772 1.796767 -1.264763
O -1.874554 1.364204 2.227255
O -2.027221 4.492073 0.510828
O 1.322658 2.900224 -0.905033
O -4.578126 -0.082538 1.680589
O 3.098571 1.259605 0.284643
O -1.372929 -3.441431 1.886530
O 2.972992 1.437677 -2.419854
O 3.957256 3.662435 -0.930658
O 2.350412 -1.295728 0.568024
O 4.774960 -0.537245 1.481269
O 4.312334 -0.636575 -1.277035
O 0.969233 -2.919028 2.217522
O 2.762815 -1.073446 3.088113
O 0.299992 -0.214517 2.066024
N -2.806256 -0.081788 0.119757
N -3.027477 -1.850647 1.659076
C -2.369039 2.195471 1.161436
C -1.346569 3.194089 0.537146
C -2.951514 1.404958 -0.091063
C -1.049648 2.674551 -0.887033
C 0.254751 1.870729 -1.001417
C -1.864769 -0.819218 -0.565232
C -3.563714 -0.624321 1.189640
C -1.416315 -2.061093 -0.136647
C -0.417132 -2.908669 -0.909085
C -1.915807 -2.498143 1.146037
C 0.140101 -2.256692 -2.192745
C 1.163206 -3.171483 -2.897169
H -3.177265 2.790388 1.609813
H -0.423630 3.241082 1.146436
H -4.019488 1.618891 -0.250097
H -1.037531 3.490982 -1.628064
H 0.377161 1.139909 -0.179363
H 0.318501 1.367643 -1.982741
H -1.004228 0.892858 2.050893
H -1.390050 5.195217 0.226092
H -1.482439 -0.335920 -1.465231
H -3.411743 -2.191656 2.547587
H 0.436300 -3.176364 -0.257324
H -0.901921 -3.872542 -1.167251
H -0.687972 -2.020033 -2.891860
H 0.635805 -1.299226 -1.934789
H 2.026469 -3.375123 -2.238087
H 1.548601 -2.700271 -3.818521
H 0.708753 -4.140449 -3.176574
H 3.590913 0.629945 -2.342584
H 4.251483 -0.743807 2.335355
H -0.175404 -3.294166 2.030247
H 2.581312 -1.076763 4.059210


