%chk=000287403.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287403

0 1
N 2.632151 0.704058 -0.953759
N -3.113491 1.503818 0.831337
C 1.144143 0.722500 -0.824314
C 0.694548 -0.778496 -0.744569
C 0.609703 1.614679 0.339815
C -0.801281 -0.893304 -0.565799
C -0.857953 1.449797 0.467818
C -1.441072 0.212069 0.019401
C 1.423651 -1.506184 0.351465
C 3.331129 0.112189 0.233488
C 2.627929 -1.107794 0.780740
C -2.844985 0.255904 0.249851
C -1.890512 2.225506 0.958855
C -1.598128 -1.971571 -0.915774
C 3.191774 2.050766 -1.267996
C -3.647960 -0.849093 -0.110400
C 3.386639 -1.835872 1.845481
C -3.001933 -1.934023 -0.682872
H 0.737656 1.141188 -1.782906
H 0.988410 -1.256439 -1.719666
H 0.887654 2.669406 0.162932
H 1.093898 1.315488 1.293804
H 0.916793 -2.378381 0.756433
H 3.477915 0.844930 1.059282
H 4.348135 -0.179707 -0.122169
H -1.875143 3.210475 1.383047
H -1.166737 -2.857985 -1.370756
H 4.259075 1.938735 -1.520783
H 3.103528 2.793202 -0.461466
H 2.690483 2.451115 -2.164112
H -4.008715 1.843012 1.115103
H -4.717942 -0.843885 0.054660
H 4.302589 -2.287139 1.439076
H 2.800465 -2.649585 2.293332
H 3.681897 -1.166831 2.664137
H -3.587013 -2.806847 -0.974715


%chk=000287403-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287403

0 1
N 2.636682 0.732358 -0.902592
N -3.152340 1.506268 0.838726
C 1.157764 0.733651 -0.793526
C 0.686799 -0.761320 -0.744372
C 0.605553 1.614110 0.393661
C -0.825202 -0.876518 -0.563088
C -0.890007 1.450130 0.497553
C -1.477858 0.220575 0.037552
C 1.462219 -1.512506 0.336476
C 3.338779 0.149753 0.257458
C 2.674580 -1.106327 0.796796
C -2.888177 0.259813 0.253073
C -1.940241 2.226499 0.982130
C -1.632116 -1.967463 -0.941576
C 3.235875 1.995289 -1.357652
C -3.699721 -0.837420 -0.119797
C 3.443222 -1.851597 1.869405
C -3.044474 -1.941381 -0.714260
H 0.762905 1.170621 -1.732802
H 0.960587 -1.202824 -1.725780
H 0.896689 2.669208 0.233006
H 1.087387 1.281761 1.335317
H 0.998898 -2.423755 0.738047
H 3.446357 0.882611 1.105149
H 4.377390 -0.092077 -0.054434
H -1.939349 3.223379 1.419850
H -1.184854 -2.844927 -1.424406
H 4.296517 1.825968 -1.623421
H 3.209498 2.818097 -0.598809
H 2.711479 2.350252 -2.262987
H -4.069461 1.852037 1.110677
H -4.784651 -0.847186 0.031929
H 4.410780 -2.229089 1.482171
H 2.869262 -2.713515 2.250529
H 3.680343 -1.191902 2.728208
H -3.643813 -2.806871 -1.020210


