%chk=000211489.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211489

0 1
O 0.283846 1.622369 -1.310258
O 5.969472 -0.286675 0.233564
N -1.806827 -0.178397 0.153750
C -4.747350 -0.246310 0.243286
C -3.967076 0.601870 -0.780601
C -3.879383 -1.447774 0.665936
C -2.609520 1.034894 -0.205458
C -2.515326 -0.985099 1.202864
C -0.393892 0.123591 0.551700
C 0.432851 0.294202 -0.763638
C -6.083385 -0.715114 -0.340098
C -0.200613 1.313880 1.493144
C 1.910278 0.121902 -0.504187
C 2.454485 -1.166310 -0.426697
C 2.739178 1.247275 -0.344004
C 3.817593 -1.347704 -0.177036
C 4.099975 1.094657 -0.098219
C 4.618713 -0.209009 -0.016653
H -4.954345 0.381168 1.144691
H -3.808468 0.015644 -1.707231
H -4.551630 1.492341 -1.071382
H -4.397694 -2.047838 1.434501
H -3.724310 -2.119129 -0.201918
H -2.042716 1.611695 -0.976825
H -2.763566 1.721852 0.654813
H -2.648973 -0.425571 2.153615
H -1.890145 -1.874614 1.434457
H 0.004327 -0.797390 1.061580
H 0.071921 -0.426069 -1.536989
H -5.943115 -1.337510 -1.231089
H -6.649878 -1.308262 0.385870
H -6.711968 0.133446 -0.630936
H 0.814376 1.314922 1.911021
H -0.314585 2.269788 0.964478
H -0.904907 1.296473 2.329185
H -0.662532 1.762562 -1.565534
H 1.816568 -2.040045 -0.562119
H 2.298737 2.245917 -0.426207
H 4.238864 -2.344551 -0.115328
H 4.761672 1.948402 0.025749
H 6.287749 -1.220483 0.269202


%chk=000211489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211489

0 1
O -0.073822 0.260417 -1.708086
O 6.104686 0.228738 0.039124
N -1.861189 0.119055 0.259448
C -4.811561 -0.278513 0.203730
C -4.144847 1.115439 0.126794
C -3.817252 -1.335001 -0.334177
C -2.774929 1.144112 0.836757
C -2.457302 -1.244064 0.383489
C -0.422339 0.140179 0.714251
C 0.404588 -0.427668 -0.514163
C -6.157130 -0.316302 -0.549504
C 0.070082 1.539425 1.120790
C 1.908697 -0.270744 -0.373562
C 2.626344 -1.092835 0.528671
C 2.621440 0.691985 -1.130507
C 4.021575 -0.947474 0.694002
C 4.014286 0.845390 -0.981051
C 4.713426 0.027738 -0.064228
H -5.001469 -0.505840 1.276254
H -4.003045 1.391839 -0.937658
H -4.802860 1.881603 0.582408
H -4.231394 -2.354297 -0.205096
H -3.664939 -1.174539 -1.420312
H -2.320444 2.139927 0.713323
H -2.925386 0.974798 1.933059
H -2.587054 -1.509062 1.463372
H -1.756045 -1.978351 -0.050513
H -0.281922 -0.548954 1.580421
H 0.179175 -1.516119 -0.595448
H -6.011531 -0.092511 -1.623938
H -6.632375 -1.312388 -0.474506
H -6.866092 0.429342 -0.143160
H 1.127629 1.475674 1.425934
H 0.010137 2.247413 0.274500
H -0.500596 1.946223 1.973103
H -1.051711 0.404157 -1.484475
H 2.100164 -1.863066 1.106893
H 2.065007 1.301314 -1.848234
H 4.563996 -1.593526 1.397294
H 4.573810 1.581366 -1.566394
H 6.500592 -0.399887 0.692395


