%chk=000291055.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291055

0 1
O 0.394944 2.301619 -0.751245
N -0.738486 -0.015083 -0.196092
N 2.610894 2.456846 -1.054375
N -2.157576 -2.318999 -2.305333
C 0.538031 -0.486995 0.061093
C -1.955424 -0.854359 -0.126253
C 1.665816 0.375310 -0.103576
C 0.745753 -1.821962 0.521769
C 2.937962 -0.106501 0.267011
C -3.177327 0.020307 0.035857
C 2.014076 -2.256894 0.853105
C 3.123144 -1.395140 0.740263
C 1.488850 1.739760 -0.639264
C -3.284702 0.927921 1.012631
C -2.070816 -1.674288 -1.352880
C -4.478193 1.797288 1.195635
H -1.882307 -1.561612 0.757616
H -0.864922 0.954161 -0.561528
H -0.096955 -2.502594 0.610201
H 3.804792 0.553218 0.185897
H -3.968535 -0.140154 -0.696558
H 2.164879 -3.278231 1.208351
H 4.111586 -1.746660 1.020836
H -2.480270 1.092377 1.737299
H -4.215060 2.856128 1.040076
H -4.881686 1.712907 2.215404
H -5.297922 1.566560 0.501516
H 3.532850 2.067331 -1.107241
H 2.482101 3.375539 -1.452018


%chk=000291055-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291055

0 1
O 0.224233 2.215215 -0.688835
N -0.749825 -0.133945 -0.120724
N 2.461298 2.650533 -0.420819
N -2.390954 -2.618509 -1.982557
C 0.547927 -0.587697 0.052574
C -1.945157 -0.940666 0.079844
C 1.659737 0.329879 -0.096145
C 0.828315 -1.952405 0.379906
C 2.980917 -0.168846 0.075146
C -3.197172 -0.090337 0.316521
C 2.145888 -2.398719 0.558763
C 3.239497 -1.509660 0.404566
C 1.401355 1.762333 -0.418417
C -3.205874 1.233583 0.609170
C -2.197594 -1.877465 -1.067476
C -4.462115 2.036191 0.856391
H -1.804109 -1.588713 0.974025
H -0.820248 0.839456 -0.478962
H 0.009968 -2.673454 0.459825
H 3.841009 0.495654 -0.069029
H -4.140725 -0.647891 0.248686
H 2.326721 -3.451951 0.800899
H 4.267455 -1.864232 0.524754
H -2.258689 1.786900 0.678140
H -4.544117 2.866937 0.129306
H -4.444829 2.496055 1.863374
H -5.370981 1.414951 0.774946
H 3.410584 2.396282 -0.163718
H 2.252983 3.618323 -0.661958


