%chk=000189431.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189431

0 1
S 0.389552 -4.303213 -0.257425
F -6.049549 1.905404 -0.035152
N 0.035060 0.226569 0.000693
C 2.439460 0.566695 0.101111
C 1.269078 -0.342091 0.007348
C 2.875500 1.308007 -1.015990
C -1.059672 -0.592108 -0.069729
C 1.464177 -1.739775 -0.060891
C -2.383067 0.073652 -0.055356
C 0.338482 -2.552772 -0.148573
C -0.944337 -1.991747 -0.157022
C 3.111524 0.673362 1.326875
C 3.998207 2.140781 -0.882264
C 2.157249 1.211989 -2.320939
C 4.224510 1.508117 1.446572
C 4.666544 2.239883 0.339643
C -3.455092 -0.506463 0.645202
C -2.563507 1.293428 -0.732780
C -4.708077 0.109031 0.658883
C -3.808928 1.924145 -0.735352
C -4.854501 1.312172 -0.038107
C 2.132498 -4.757143 -0.216027
H 2.474837 -2.137686 -0.047201
H -1.834271 -2.613835 -0.240158
H 2.757297 0.108146 2.188746
H 4.346775 2.718135 -1.736486
H 2.098490 0.173053 -2.675630
H 1.120211 1.573642 -2.218439
H 2.629794 1.802312 -3.115182
H 4.742381 1.591715 2.399457
H 5.533935 2.892335 0.431144
H -3.310021 -1.439335 1.192408
H -1.718168 1.752787 -1.252183
H -5.541388 -0.335779 1.200302
H -3.954347 2.866961 -1.260486
H 2.620952 -4.453236 0.717405
H 2.692164 -4.342916 -1.063007
H 2.184145 -5.854323 -0.281909


%chk=000189431-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189431

0 1
S 0.407994 -4.470858 0.462417
F -6.053769 2.047715 -0.385673
N 0.069987 0.137402 -0.133352
C 2.501592 0.470166 -0.102731
C 1.308641 -0.432014 -0.043939
C 2.625729 1.517921 -1.070325
C -1.039973 -0.668395 -0.039919
C 1.489903 -1.833090 0.128527
C -2.362586 0.017462 -0.138280
C 0.350672 -2.660119 0.233960
C -0.933074 -2.067519 0.158408
C 3.540793 0.268794 0.846128
C 3.793408 2.322707 -1.038675
C 1.577420 1.779453 -2.137663
C 4.689864 1.085786 0.865443
C 4.816172 2.122447 -0.085287
C -3.567490 -0.694146 -0.389618
C -2.426681 1.429860 0.017428
C -4.805280 -0.023925 -0.474864
C -3.653606 2.117825 -0.060994
C -4.819606 1.371009 -0.304377
C 2.251502 -4.818592 0.526681
H 2.503884 -2.238762 0.152657
H -1.827221 -2.686901 0.271105
H 3.425306 -0.517786 1.601131
H 3.899625 3.120510 -1.783719
H 1.258142 0.846637 -2.636058
H 0.664845 2.216368 -1.697496
H 1.968424 2.469352 -2.905835
H 5.470288 0.920532 1.616220
H 5.701770 2.767883 -0.087158
H -3.551889 -1.777528 -0.544514
H -1.492424 1.967191 0.201961
H -5.736829 -0.560971 -0.674691
H -3.713518 3.202773 0.064409
H 2.716794 -4.294745 1.375876
H 2.734425 -4.538366 -0.422085
H 2.334661 -5.906176 0.674404


