%chk=000268590.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268590

0 1
P -4.287791 0.562270 -0.461971
P 4.783908 -0.202019 0.484606
O -4.144419 1.321690 -1.742716
O 5.765229 0.005814 1.592774
N -5.387209 -0.822751 -0.563505
N -4.939131 1.526813 0.866467
N 4.750813 -1.852376 -0.149966
N 5.100812 0.784692 -0.951613
N -2.778814 -0.107594 0.128322
N 3.122936 0.159540 0.914809
C -5.751123 -1.305757 -1.932564
C -4.871355 -2.146011 -1.033623
C -6.360063 1.396016 1.312381
C -5.906492 2.622138 0.550292
C 5.976668 -2.695837 0.000056
C 5.529414 -2.232317 -1.368839
C 5.997630 1.971079 -0.785118
C 4.521053 2.160015 -1.053797
C -1.620093 0.797886 -0.155147
C 2.107279 -0.338562 -0.065416
C -2.829305 -0.571532 1.542489
C 2.826754 -0.241639 2.319190
C -0.361671 -0.024687 -0.233423
C 0.840062 0.461441 0.085901
H -5.345727 -0.830550 -2.835600
H -6.808598 -1.559828 -2.064842
H -5.289440 -3.011135 -0.506557
H -3.813260 -2.304759 -1.268996
H -6.501275 1.443638 2.398186
H -7.045259 0.670630 0.860813
H -6.248250 2.813948 -0.472803
H -5.720191 3.564044 1.079447
H 5.787858 -3.725780 0.323625
H 6.891407 -2.305170 0.460956
H 6.111287 -1.498989 -1.936954
H 5.009967 -2.923594 -2.042269
H 6.727832 2.111872 -1.589755
H 6.432738 2.229953 0.188856
H 3.855168 2.566709 -0.284789
H 4.173873 2.434311 -2.056703
H -1.516589 1.614615 0.597284
H -1.767234 1.298506 -1.152302
H 2.484031 -0.193468 -1.109918
H 1.904277 -1.431292 0.042076
H -1.881132 -1.086420 1.782497
H -3.638675 -1.311886 1.672345
H -2.967554 0.229872 2.290252
H 1.883363 0.241546 2.631396
H 3.618784 0.127284 3.001815
H 2.710881 -1.327311 2.476762
H -0.507455 -1.043752 -0.596802
H 0.984282 1.477892 0.456590


%chk=000268590-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268590

0 1
P -4.189063 0.342602 -0.215500
P 4.335669 -0.439433 0.333546
O -4.476403 0.279491 -1.801805
O 5.060853 -0.657864 1.756826
N -4.665835 -1.085531 0.756493
N -5.056043 1.618447 0.703799
N 5.154449 -1.104726 -1.114259
N 4.138074 1.266620 -0.203843
N -2.520434 0.568271 0.149315
N 2.757977 -1.127888 0.254326
C -5.952394 -1.799594 0.390307
C -4.611527 -2.431894 0.063381
C -6.474276 1.958464 0.283641
C -5.338916 2.913510 -0.033770
C 5.918575 -2.400519 -0.930785
C 6.670647 -1.098720 -1.139235
C 5.287414 2.227266 0.042440
C 4.035587 2.310061 0.894626
C -1.553012 0.801092 -0.947266
C 1.952617 -1.049491 -0.989215
C -2.045302 0.684522 1.538171
C 2.118645 -1.662876 1.466609
C -0.467295 -0.256826 -0.989229
C 0.862824 0.003771 -0.912927
H -6.533641 -1.417178 -0.458329
H -6.532158 -2.147036 1.250437
H -4.217677 -3.239028 0.687852
H -4.320299 -2.453544 -0.994673
H -7.150616 2.163042 1.118802
H -6.908386 1.414041 -0.564709
H -5.032338 2.984197 -1.085367
H -5.191798 3.812335 0.572053
H 5.803364 -3.106175 -1.758578
H 5.953311 -2.839108 0.074671
H 7.200530 -0.693756 -0.267500
H 7.101794 -0.860720 -2.116010
H 5.451870 2.942937 -0.768552
H 6.190830 1.842538 0.532231
H 4.120347 1.966189 1.933378
H 3.292434 3.089509 0.702462
H -1.090984 1.805074 -0.835383
H -2.129014 0.794220 -1.893878
H 2.644033 -0.826217 -1.822755
H 1.506788 -2.046874 -1.182466
H -1.200854 -0.009552 1.712829
H -2.860097 0.427988 2.233540
H -1.704536 1.717082 1.757912
H 1.235337 -1.060944 1.760840
H 2.849824 -1.654411 2.293135
H 1.789098 -2.707230 1.296539
H -0.819917 -1.294235 -1.101592
H 1.220121 1.037300 -0.788336


