%chk=000189732.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189732

0 1
N 2.166091 0.962599 0.556914
N 3.419886 0.024667 -1.194914
N 4.474222 0.126897 0.980061
C 1.173057 0.752905 -0.565157
C 0.061050 -0.221934 -0.245799
C 2.069611 0.269286 -1.758816
C -1.295316 0.242404 -0.127945
C 3.399485 0.341620 0.084783
C 0.345209 -1.558138 -0.063249
C -2.320546 -0.696531 0.163830
C 1.709220 0.646384 1.929892
C -1.658434 1.618570 -0.290966
C -0.685749 -2.493046 0.231045
C -1.988063 -2.076684 0.340562
C -3.675865 -0.247311 0.280033
C -2.962869 2.024754 -0.173180
C -3.988650 1.077794 0.115669
H 0.757604 1.771452 -0.788308
H 1.691512 -0.653652 -2.241297
H 2.136992 1.044485 -2.548322
H 1.371567 -1.924038 -0.143942
H 2.404224 1.104063 2.652826
H 1.643782 -0.432904 2.146043
H 0.712647 1.091027 2.096337
H -0.868112 2.341173 -0.511878
H -0.418221 -3.540751 0.364095
H -2.785978 -2.783803 0.562312
H -4.449927 -0.981100 0.500907
H 5.354222 -0.084041 0.511443
H 4.595388 0.854532 1.676241
H -3.236170 3.071489 -0.297846
H -5.016269 1.427133 0.201827


%chk=000189732-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189732

0 1
N 2.172033 0.900153 0.455305
N 3.444430 -0.250848 -1.116437
N 4.321921 -0.014682 1.091847
C 1.218733 0.743721 -0.689677
C 0.078411 -0.231103 -0.370577
C 2.215204 0.244082 -1.810352
C -1.279168 0.215083 -0.137538
C 3.341589 0.176828 0.132543
C 0.372699 -1.601404 -0.279857
C -2.302243 -0.773775 0.167772
C 1.712709 1.203853 1.809335
C -1.681846 1.596052 -0.185724
C -0.631273 -2.565586 0.029250
C -1.949019 -2.159667 0.245015
C -3.654650 -0.349331 0.392666
C -3.006235 1.978541 0.039510
C -4.006820 0.998719 0.329745
H 0.814676 1.733028 -0.959698
H 1.764892 -0.556863 -2.422254
H 2.478080 1.080879 -2.487499
H 1.402283 -1.935909 -0.455028
H 2.542869 1.623145 2.408404
H 1.289007 0.326077 2.344466
H 0.927734 1.978536 1.765937
H -0.942941 2.372961 -0.404904
H -0.361784 -3.625755 0.087855
H -2.730546 -2.893773 0.474906
H -4.411572 -1.110757 0.616869
H 5.169166 -0.489620 0.794826
H 4.153233 0.137561 2.080300
H -3.283601 3.037637 -0.006058
H -5.042370 1.311519 0.502255


