%chk=000199015.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199015

0 1
O 0.604373 -0.967462 -0.307930
O 1.426911 1.550631 0.848354
N -2.738740 0.438320 0.272773
C -3.924555 -0.071128 1.041042
C -3.289219 0.858952 -1.060419
C -4.984097 -0.556505 0.027725
C -4.579309 0.052376 -1.327189
C -1.666191 -0.595659 0.143781
C -0.337714 0.139182 -0.097566
C 0.108996 0.985659 1.097064
C 1.934666 -0.600237 -0.208297
C 2.340126 0.624247 0.372716
C 2.882338 -1.506568 -0.689217
C 3.693619 0.958205 0.453357
C 4.237572 -1.169128 -0.596759
C 4.637533 0.050330 -0.040453
H -4.308310 0.791194 1.628672
H -3.648237 -0.856408 1.766562
H -2.550706 0.743391 -1.873442
H -3.513509 1.944439 -0.978255
H -5.995379 -0.237842 0.327758
H -5.008129 -1.657516 -0.025438
H -4.407190 -0.735513 -2.078989
H -5.374007 0.699437 -1.732391
H -1.593985 -1.195916 1.077366
H -1.834653 -1.332095 -0.672511
H -0.334757 0.734274 -1.036475
H -0.519682 1.886031 1.233600
H 0.160090 0.406654 2.034423
H 2.558202 -2.448218 -1.125792
H 3.991359 1.906724 0.894672
H 4.986717 -1.866493 -0.967749
H 5.695966 0.298845 0.015308


%chk=000199015-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000199015

0 1
O 0.577833 -0.993659 -0.273896
O 1.454327 1.502831 0.978476
N -2.791821 0.532674 0.271284
C -4.021714 0.125484 1.011797
C -3.316608 0.923670 -1.075144
C -4.896966 -0.668839 -0.009352
C -4.536158 -0.022209 -1.386350
C -1.739779 -0.517222 0.212943
C -0.359185 0.125213 0.014609
C 0.130095 0.897406 1.243864
C 1.942543 -0.627518 -0.198467
C 2.367841 0.593779 0.396833
C 2.894374 -1.515116 -0.740783
C 3.737470 0.927392 0.415992
C 4.266361 -1.184093 -0.708736
C 4.687139 0.042809 -0.139307
H -4.554939 1.043005 1.328304
H -3.763879 -0.446346 1.919082
H -2.519946 0.858330 -1.835999
H -3.653664 1.975820 -1.030938
H -5.974032 -0.598057 0.222105
H -4.621488 -1.739051 0.002948
H -4.271845 -0.792013 -2.132004
H -5.381427 0.557172 -1.797554
H -1.736978 -1.077090 1.166822
H -1.889123 -1.262273 -0.602172
H -0.363878 0.807238 -0.860159
H -0.550284 1.731214 1.469760
H 0.209444 0.216934 2.115698
H 2.540313 -2.449602 -1.187844
H 4.035736 1.874525 0.876646
H 5.000765 -1.877234 -1.132005
H 5.749571 0.307030 -0.120152


