%chk=000259145.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259145

0 1
O 1.741869 1.702049 2.971927
N -1.055591 1.329705 -0.088235
N 1.788245 1.186043 0.722927
C 0.060205 2.728648 1.569318
C -0.429318 3.422193 2.859860
C -1.962955 3.297975 2.897934
C -2.340163 2.169874 1.926598
C -1.148270 1.978562 1.020134
C 1.263301 1.815758 1.858722
C -2.135445 0.609470 -0.691706
C 2.875486 0.250501 0.700904
C -2.202551 -0.797224 -0.568908
C 3.052558 -0.550274 -0.458424
C -3.053255 1.315896 -1.489478
C -3.224636 -1.482378 -1.260637
C 3.761585 0.149088 1.785243
C 4.153136 -1.428834 -0.507029
C -1.224495 -1.539203 0.282628
C -4.045959 0.616661 -2.174015
C -4.135104 -0.771615 -2.057575
C 2.109693 -0.478693 -1.618386
C 4.836100 -0.736797 1.717031
C 5.037274 -1.518384 0.579907
C -3.355216 -2.968620 -1.153871
C 4.396526 -2.280696 -1.713479
H 0.378112 3.501718 0.823415
H -0.105228 4.475020 2.890460
H 0.026552 2.939504 3.752102
H -2.439793 4.247390 2.595325
H -2.319090 3.085123 3.920478
H -3.256338 2.402664 1.352782
H -2.554871 1.226066 2.467758
H 1.257452 1.257058 -0.166919
H -2.976341 2.396398 -1.582133
H 3.607671 0.756609 2.682564
H -0.916678 -2.488975 -0.175879
H -0.296237 -0.974492 0.458922
H -1.654488 -1.772638 1.266523
H -4.755482 1.156122 -2.799924
H -4.917815 -1.306332 -2.591665
H 1.187986 0.089882 -1.411945
H 2.590786 -0.007692 -2.487512
H 1.779010 -1.480987 -1.926905
H 5.522276 -0.814256 2.559818
H 5.882403 -2.200832 0.536053
H -2.478131 -3.475575 -1.582198
H -3.438834 -3.289363 -0.105506
H -4.237917 -3.354841 -1.679603
H 4.494267 -1.668267 -2.621128
H 5.313107 -2.878527 -1.629008
H 3.567301 -2.983082 -1.878664


%chk=000259145-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259145

0 1
O 2.083482 2.033582 3.004968
N -0.895329 1.130375 0.031891
N 1.734698 1.006616 0.901957
C 0.098975 2.659167 1.718584
C -0.508830 3.239753 3.020898
C -1.990995 3.514875 2.652231
C -2.379407 2.328658 1.732218
C -1.073768 1.943627 1.035281
C 1.402910 1.848791 1.949597
C -1.981710 0.482506 -0.648552
C 2.902140 0.200699 0.747125
C -2.243685 -0.901605 -0.426429
C 3.040743 -0.532762 -0.477041
C -2.724995 1.219017 -1.607775
C -3.283600 -1.531744 -1.175220
C 3.897599 0.127413 1.757379
C 4.193069 -1.349143 -0.663932
C -1.448353 -1.691369 0.598825
C -3.743756 0.583754 -2.343951
C -4.022619 -0.783506 -2.124423
C 1.969189 -0.418970 -1.551769
C 5.030660 -0.682346 1.550436
C 5.177897 -1.415954 0.355095
C -3.599943 -3.001446 -0.958082
C 4.400057 -2.154394 -1.939366
H 0.387076 3.502140 1.051190
H 0.027283 4.137272 3.365798
H -0.431525 2.487708 3.826786
H -2.076093 4.467367 2.094891
H -2.640297 3.590803 3.540838
H -3.187689 2.548887 1.014242
H -2.718494 1.459016 2.332658
H 0.973356 0.916119 0.194377
H -2.481910 2.273524 -1.778616
H 3.766418 0.700971 2.676146
H -1.079678 -2.644361 0.176142
H -0.579478 -1.123214 0.967616
H -2.071317 -1.956362 1.476223
H -4.315774 1.150822 -3.086658
H -4.816874 -1.277573 -2.695917
H 0.986089 -0.791338 -1.203115
H 1.816590 0.631902 -1.866691
H 2.232692 -0.994241 -2.451521
H 5.799552 -0.740747 2.328977
H 6.061812 -2.046599 0.203798
H -2.743697 -3.647805 -1.232773
H -3.831839 -3.217908 0.102090
H -4.465801 -3.314848 -1.565409
H 4.457245 -1.505788 -2.834377
H 5.341138 -2.727625 -1.885572
H 3.579489 -2.876314 -2.112468


