%chk=000288932.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288932

0 1
O -3.312581 2.883065 0.039854
O -1.920912 1.773955 -1.354086
N -3.061191 -0.736251 -0.105740
C -2.132287 -0.433170 1.023130
C -3.104700 0.632100 0.494061
C -4.225381 -1.646494 0.146064
C -0.668478 -0.407686 0.750152
C -2.663786 1.740802 -0.407471
C -3.722537 -3.080211 -0.051624
C -5.323915 -1.282723 -0.857593
C 0.216546 -0.410914 1.841907
C -0.157636 -0.390122 -0.555918
C 1.594759 -0.402219 1.627977
C 1.221963 -0.381834 -0.769606
C 2.106088 -0.389140 0.319679
C -3.026048 4.113355 -0.673969
C 3.568458 -0.378744 0.093538
C 4.155716 0.643642 -0.668984
C 4.374600 -1.390294 0.639634
C 5.536816 0.652602 -0.879449
C 5.754709 -1.377318 0.422267
C 6.338006 -0.356765 -0.335653
H -2.368176 -0.833273 2.027927
H -3.942050 0.939715 1.146870
H -4.633080 -1.542333 1.186667
H -4.538685 -3.803060 0.044697
H -3.278269 -3.211306 -1.049006
H -2.946120 -3.343501 0.675581
H -5.705255 -0.268616 -0.694310
H -6.167648 -1.976896 -0.791145
H -4.946123 -1.318137 -1.889746
H -0.167111 -0.416158 2.860536
H -0.848376 -0.364116 -1.407314
H 2.277566 -0.397819 2.476088
H 1.611468 -0.370126 -1.787185
H -3.225970 3.979884 -1.742161
H -3.717267 4.825922 -0.212691
H -1.980465 4.391039 -0.508248
H 3.532596 1.431368 -1.090560
H 3.921064 -2.187791 1.225738
H 5.989644 1.448067 -1.468952
H 6.376917 -2.164814 0.843911
H 7.413030 -0.348283 -0.502468


%chk=000288932-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288932

0 1
O -3.243825 2.944015 0.303842
O -2.152007 1.829471 -1.435449
N -3.124964 -0.756818 -0.225871
C -2.187129 -0.493043 0.903618
C -3.206661 0.589840 0.421826
C -4.274058 -1.683985 0.038733
C -0.713019 -0.456587 0.665073
C -2.798834 1.790817 -0.366435
C -3.777283 -3.128864 -0.151337
C -5.420801 -1.322699 -0.922098
C 0.168728 -0.460871 1.777061
C -0.159974 -0.426654 -0.640661
C 1.564369 -0.430302 1.592206
C 1.235915 -0.402815 -0.820880
C 2.128955 -0.398943 0.287064
C -2.869240 4.228056 -0.333757
C 3.606327 -0.366538 0.086871
C 4.179938 0.325652 -1.016260
C 4.485185 -1.024113 0.992496
C 5.577589 0.358263 -1.207778
C 5.883241 -0.990806 0.803776
C 6.438303 -0.299358 -0.298197
H -2.473690 -0.900177 1.889648
H -4.026070 0.781795 1.129581
H -4.632543 -1.561322 1.093016
H -4.596014 -3.846642 0.036726
H -3.414203 -3.271557 -1.184373
H -2.945907 -3.360618 0.538743
H -5.758239 -0.281231 -0.769179
H -6.284741 -1.992922 -0.763784
H -5.083030 -1.423046 -1.968561
H -0.241290 -0.478675 2.795064
H -0.839489 -0.429934 -1.497178
H 2.222695 -0.401898 2.467798
H 1.641251 -0.413521 -1.838757
H -3.277248 4.281492 -1.357319
H -3.309878 5.001490 0.310812
H -1.771272 4.325222 -0.378375
H 3.527763 0.866322 -1.711541
H 4.068838 -1.591456 1.832817
H 5.995567 0.904735 -2.060860
H 6.538983 -1.512568 1.510153
H 7.523660 -0.273806 -0.445877


