%chk=000260248.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260248

0 1
O 4.340831 1.428030 -0.892256
O 4.338050 -1.438844 0.888941
N -3.160484 2.560335 -0.182773
N -3.166118 -2.555441 0.184020
N 3.160551 1.871343 1.043857
N 3.155599 -1.879716 -1.046398
C -5.237420 0.448900 0.626430
C -5.238971 -0.439749 -0.623761
C -5.501521 1.929644 0.325377
C -5.506174 -1.919898 -0.322499
C -4.541169 2.551823 -0.703464
C -4.546431 -2.544229 0.705616
C -2.235088 1.928675 -0.829935
C -2.238807 -1.926648 0.831233
C -0.838505 1.945186 -0.343050
C -0.842613 -1.945823 0.343338
C -0.527585 2.250990 0.992456
C -0.533224 -2.252242 -0.992386
C 0.201080 1.641570 -1.239553
C 0.198201 -1.644171 1.239085
C 1.826585 1.910858 0.528040
C 1.821926 -1.916627 -0.529653
C 0.793089 2.230859 1.434744
C 0.787172 -2.234669 -1.435613
C 1.528161 1.630803 -0.817121
C 1.524993 -1.635941 0.815705
C 4.333194 1.575755 0.318346
C 4.329332 -1.586566 -0.321652
C 5.560140 1.433111 1.170656
C 5.556010 -1.446474 -1.174773
H -4.262977 0.350609 1.145896
H -6.002185 0.093861 1.344817
H -4.264751 -0.343680 -1.144063
H -6.003536 -0.082964 -1.341493
H -5.431916 2.502645 1.273876
H -6.538859 2.061333 -0.038997
H -5.438579 -2.493049 -1.271046
H -6.543526 -2.049252 0.042680
H -4.658566 2.047011 -1.687375
H -4.821591 3.621287 -0.862752
H -4.662167 -2.039337 1.689683
H -4.828950 -3.613143 0.864907
H -2.379638 1.352973 -1.761019
H -2.381413 -1.351548 1.762984
H -1.333272 2.508413 1.685230
H -1.339894 -2.508116 -1.684596
H -0.026054 1.410851 -2.280755
H -0.027744 -1.412999 2.280446
H 1.014499 2.464015 2.472766
H 1.007392 -2.468290 -2.473783
H 2.331043 1.402817 -1.524863
H 2.328824 -1.409445 1.522852
H 3.238911 1.975848 2.058947
H 3.233045 -1.984204 -2.061563
H 5.600420 0.403682 1.584982
H 5.622911 2.135455 2.007938
H 6.468087 1.565982 0.563174
H 5.598190 -0.417095 -1.589051
H 5.616718 -2.148866 -2.012166
H 6.464073 -1.581339 -0.567914


%chk=000260248-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260248

0 1
O 4.438065 1.392375 -0.927143
O 4.432905 -1.399369 0.923045
N -3.227181 2.604918 0.020221
N -3.234487 -2.601832 -0.018363
N 3.235826 2.119741 0.955529
N 3.228818 -2.128623 -0.957690
C -5.350358 0.427750 0.650320
C -5.351902 -0.419205 -0.647595
C -5.600157 1.936824 0.418428
C -5.605847 -1.927546 -0.415500
C -4.593453 2.617711 -0.539086
C -4.600528 -2.611164 0.541532
C -2.251070 2.176184 -0.735383
C -2.257213 -2.174096 0.736300
C -0.842864 2.162291 -0.299065
C -0.849224 -2.163104 0.299203
C -0.460915 2.582896 1.005231
C -0.468649 -2.586275 -1.004662
C 0.170933 1.736661 -1.196345
C 0.165719 -1.737741 1.195306
C 1.896118 2.131377 0.481362
C 1.889364 -2.137655 -0.482743
C 0.886778 2.565680 1.390101
C 0.878869 -2.571817 -1.390263
C 1.529590 1.720982 -0.827630
C 1.524191 -1.724707 0.825817
C 4.404211 1.735265 0.294503
C 4.398058 -1.744677 -0.297894
C 5.644625 1.706188 1.178606
C 5.637919 -1.718119 -1.182856
H -4.386377 0.301328 1.180821
H -6.138907 0.048726 1.333277
H -4.387832 -0.295491 -1.178568
H -6.139733 -0.037979 -1.330157
H -5.565734 2.467958 1.389459
H -6.617462 2.083016 0.000420
H -5.573448 -2.458850 -1.386509
H -6.623324 -2.070825 0.003095
H -4.648103 2.151989 -1.551602
H -4.893773 3.680108 -0.646578
H -4.653536 -2.145309 1.554071
H -4.903566 -3.672777 0.649109
H -2.432829 1.802744 -1.770578
H -2.437824 -1.798776 1.771013
H -1.244591 2.919308 1.691662
H -1.253223 -2.922486 -1.690164
H -0.110071 1.407384 -2.204817
H -0.114230 -1.406514 2.203436
H 1.169447 2.888662 2.401085
H 1.160488 -2.896755 -2.400913
H 2.306098 1.399453 -1.522971
H 2.301589 -1.403429 1.520278
H 3.349897 2.377602 1.938537
H 3.341959 -2.388028 -1.940397
H 5.795954 0.659997 1.504944
H 5.566963 2.350785 2.072204
H 6.520417 2.015535 0.586750
H 5.790127 -0.672572 -1.510821
H 5.558986 -2.363869 -2.075504
H 6.513799 -2.027555 -0.591166


