%chk=000217863.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217863

0 1
N -0.264578 -0.041747 0.517817
N -3.979555 -0.421261 0.080736
N 2.706175 -2.767218 -0.568060
C 0.443217 1.172230 0.311966
C 1.736029 0.887140 -0.109931
C -0.102921 2.533845 0.555751
C 2.745796 1.935673 -0.405620
C 0.821162 3.583214 -0.095318
C 2.306023 3.292699 0.177710
C 1.860332 -0.541562 -0.206405
C 0.588393 -1.102359 0.178366
C -1.684883 -0.169907 0.879914
C -2.568470 -0.244705 -0.387897
C 0.391752 -2.497041 0.181397
C 2.889491 -1.433777 -0.569574
C 1.479223 -3.275180 -0.198413
C -4.748388 -1.300160 -0.848773
C -4.662901 0.897143 0.235554
H -1.130767 2.636620 0.155794
H -0.173531 2.717060 1.649323
H 3.735177 1.649692 0.004682
H 2.882493 2.016813 -1.504681
H 0.644623 3.599159 -1.188780
H 0.559119 4.590019 0.278004
H 2.489422 3.298261 1.269965
H 2.930414 4.100704 -0.245327
H -1.832324 -1.087136 1.498106
H -1.986098 0.686838 1.522056
H -2.413799 0.652184 -1.022857
H -2.247469 -1.111797 -1.006063
H -0.555827 -2.936825 0.467493
H 3.876984 -1.066299 -0.866571
H 1.412873 -4.368177 -0.224109
H -4.272689 -2.294115 -0.879368
H -4.837705 -0.923925 -1.878162
H -5.764207 -1.444816 -0.445409
H -5.656791 0.729772 0.682953
H -4.798128 1.462664 -0.698094
H -4.094267 1.522377 0.941125


%chk=000217863-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217863

0 1
N -0.258972 -0.019160 0.477188
N -4.004339 -0.517462 0.008526
N 2.727140 -2.823116 -0.453452
C 0.457030 1.183683 0.254976
C 1.760604 0.890184 -0.145681
C -0.111179 2.563422 0.453035
C 2.788972 1.958471 -0.435703
C 0.841226 3.609889 -0.190441
C 2.326396 3.321695 0.145234
C 1.872396 -0.552963 -0.191336
C 0.592304 -1.092281 0.199838
C -1.673725 -0.134735 0.853151
C -2.598630 -0.282759 -0.382733
C 0.386434 -2.487452 0.259965
C 2.904505 -1.473752 -0.506415
C 1.490664 -3.299708 -0.076465
C -4.791671 -1.164543 -1.062653
C -4.675904 0.692281 0.527687
H -1.122235 2.653555 0.006033
H -0.228123 2.782071 1.536090
H 3.771921 1.680647 -0.007390
H 2.947155 2.055968 -1.530337
H 0.710617 3.591914 -1.290685
H 0.559877 4.622695 0.154509
H 2.452964 3.313073 1.246440
H 2.965241 4.134486 -0.249117
H -1.811482 -1.017403 1.502434
H -1.950037 0.753495 1.446929
H -2.481418 0.617398 -1.040657
H -2.250531 -1.153724 -0.967967
H -0.567603 -2.937686 0.552684
H 3.901237 -1.130931 -0.809495
H 1.398628 -4.391357 -0.048416
H -4.304334 -2.107952 -1.365466
H -4.912501 -0.527241 -1.974599
H -5.800093 -1.409166 -0.683409
H -5.698654 0.433613 0.853986
H -4.751267 1.511023 -0.233283
H -4.139215 1.089928 1.406294


