%chk=000291403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291403

0 1
O -6.899107 -1.983801 -0.569770
N -6.566326 0.276575 -0.243063
N 7.718447 -1.756169 -0.333332
N 6.075985 -2.384262 1.333205
C -0.125623 0.539031 -0.068586
C 1.361101 0.614108 0.296110
C -1.006680 0.457100 1.188424
C 2.243756 0.674479 -0.961093
C -2.462285 0.394712 0.816812
C 3.697867 0.753765 -0.584235
C 4.407762 -0.417138 -0.276340
C -3.074881 -0.839150 0.548116
C -3.223471 1.569691 0.723861
C 4.350327 1.994448 -0.523242
C 5.758027 -0.339067 0.082835
C -4.421945 -0.909547 0.196564
C -4.572282 1.519224 0.374471
C -5.176845 0.272793 0.109355
C 5.696782 2.064667 -0.154235
C 6.407791 0.901614 0.150619
C 6.505877 -1.593459 0.405778
C -7.348001 -0.855715 -0.561538
C -8.780078 -0.526803 -0.887404
H -0.317657 -0.340650 -0.713898
H -0.417736 1.421249 -0.670737
H 1.555859 1.500514 0.931053
H 1.649444 -0.261614 0.911640
H -0.809851 1.327034 1.847058
H -0.724265 -0.430291 1.791575
H 2.058597 -0.216050 -1.596292
H 1.952727 1.542532 -1.586283
H 3.906095 -1.385336 -0.293100
H -2.493353 -1.759030 0.613535
H -2.759174 2.534248 0.925688
H 3.805223 2.907496 -0.755655
H -4.885913 -1.880523 -0.009597
H -5.144057 2.440966 0.310008
H 6.193632 3.032384 -0.099414
H 7.453275 0.956874 0.451562
H -7.011095 1.195543 -0.258557
H 7.815806 -1.239840 -1.194779
H 8.114534 -2.681685 -0.387951
H 6.589620 -3.228016 1.562225
H -8.873933 0.128940 -1.762483
H -9.327470 -1.455331 -1.125106
H -9.306203 -0.055612 -0.047202


%chk=000291403-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291403

0 1
O -7.133863 -2.064031 -0.368656
N -6.655728 0.234101 -0.257636
N 8.011999 -1.586178 0.087505
N 5.930537 -2.753664 0.496977
C -0.137832 0.513064 -0.057998
C 1.364687 0.611590 0.282744
C -1.042476 0.511296 1.206468
C 2.264975 0.617246 -0.984661
C -2.521696 0.422563 0.864389
C 3.744370 0.710962 -0.643341
C 4.504484 -0.455430 -0.396224
C -3.167463 -0.830503 0.711463
C -3.293709 1.591026 0.637528
C 4.382538 1.974004 -0.520777
C 5.871960 -0.384718 -0.031774
C -4.525143 -0.938194 0.343570
C -4.650612 1.508527 0.269988
C -5.279448 0.243628 0.116730
C 5.740789 2.060910 -0.146359
C 6.487545 0.887453 0.100426
C 6.618477 -1.666340 0.203153
C -7.499362 -0.857332 -0.479846
C -8.923801 -0.458702 -0.875066
H -0.330046 -0.410068 -0.641381
H -0.430762 1.360051 -0.711652
H 1.556721 1.533019 0.869563
H 1.659747 -0.237667 0.931202
H -0.839006 1.432928 1.787007
H -0.748837 -0.342073 1.848771
H 2.065531 -0.306980 -1.561144
H 1.967566 1.469587 -1.627254
H 4.053777 -1.450992 -0.474133
H -2.596399 -1.750735 0.888084
H -2.828027 2.577407 0.754386
H 3.810294 2.889300 -0.717800
H -5.008627 -1.910141 0.232255
H -5.226811 2.429113 0.104461
H 6.217631 3.041821 -0.039570
H 7.527740 0.976792 0.435770
H -7.077105 1.158010 -0.382539
H 8.464193 -0.764674 -0.307001
H 8.587596 -2.405025 0.272086
H 6.525614 -3.600713 0.611430
H -8.932013 0.133180 -1.809389
H -9.511444 -1.374269 -1.032561
H -9.408258 0.141753 -0.082597


