%chk=000214327.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214327

0 1
O -1.256573 -0.269449 0.842370
O -2.056102 -1.953930 -0.438914
N 2.311239 -0.690430 0.923277
C 3.317398 0.283740 0.404772
C 4.372967 0.493746 1.513995
C 4.001390 -0.172967 -0.905805
C 5.426058 1.515270 1.067734
C 5.053625 0.850087 -1.349855
C 6.095030 1.092747 -0.247921
C 1.033393 -0.740960 0.155031
C -0.072306 -1.049660 1.191615
C 1.036835 -1.774397 -0.975131
C -2.192987 -0.835438 0.007645
C -3.317756 0.103762 -0.221494
C -4.378388 -0.321446 -1.038260
C -3.335984 1.382445 0.354874
C -5.454244 0.536008 -1.276378
C -4.415909 2.234759 0.111978
C -5.472600 1.812216 -0.701969
H 2.791525 1.256195 0.219796
H 4.859500 -0.465713 1.769196
H 3.872803 0.835011 2.440604
H 3.244222 -0.311714 -1.700817
H 4.477127 -1.160645 -0.762268
H 6.190539 1.632926 1.858435
H 4.956835 2.510710 0.947274
H 4.560733 1.804860 -1.616449
H 5.554732 0.497682 -2.270745
H 6.813541 1.868045 -0.572020
H 6.688520 0.172596 -0.085934
H 2.719397 -1.625437 1.011612
H 0.816446 0.274480 -0.274653
H -0.333780 -2.117828 1.252204
H 0.166282 -0.644439 2.194286
H 0.029455 -1.892503 -1.405428
H 1.337642 -2.769991 -0.631974
H 1.713700 -1.481847 -1.785808
H -4.351579 -1.321409 -1.479880
H -2.505102 1.701131 0.990207
H -6.278848 0.210343 -1.908842
H -4.434222 3.228179 0.557719
H -6.314055 2.479462 -0.889381


%chk=000214327-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214327

0 1
O -1.272976 0.254162 0.590004
O -2.248633 -1.870158 0.689074
N 2.378572 -0.661015 0.617604
C 3.551529 0.231364 0.472441
C 4.659965 -0.206629 1.458514
C 4.124990 0.316716 -0.974191
C 5.897725 0.719510 1.384216
C 5.353343 1.256807 -1.049008
C 6.454667 0.813906 -0.056758
C 1.099176 -0.272539 -0.022756
C 0.025995 -0.287094 1.092918
C 0.703881 -1.176196 -1.212153
C -2.333589 -0.643399 0.428719
C -3.562922 0.035256 -0.081730
C -4.724820 -0.755035 -0.281499
C -3.594853 1.425272 -0.366157
C -5.909304 -0.159864 -0.761666
C -4.782568 2.016378 -0.846752
C -5.940367 1.226735 -1.045377
H 3.221208 1.250591 0.766764
H 4.966127 -1.246873 1.212564
H 4.240958 -0.226885 2.481740
H 3.336236 0.659375 -1.673149
H 4.421724 -0.705183 -1.293947
H 6.681731 0.356385 2.076593
H 5.612602 1.734982 1.729823
H 5.036996 2.292251 -0.803011
H 5.751618 1.282988 -2.081980
H 7.309221 1.517322 -0.091725
H 6.842923 -0.179421 -0.364257
H 2.613289 -1.651132 0.473641
H 1.196627 0.770638 -0.385089
H -0.131703 -1.311206 1.474468
H 0.326709 0.385584 1.911589
H -0.257910 -0.858879 -1.652608
H 0.589503 -2.226427 -0.882546
H 1.475782 -1.136710 -2.001212
H -4.675224 -1.825016 -0.054026
H -2.693059 2.022297 -0.205743
H -6.805337 -0.771133 -0.914262
H -4.807989 3.089393 -1.066058
H -6.861346 1.689078 -1.418310


