%chk=000271888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271888

0 1
O 2.924302 1.216862 0.549937
N 1.702087 -0.743722 0.278761
N 3.941885 -0.525548 -0.550876
C -0.490249 0.367278 -0.517979
C -1.896377 0.444573 0.209124
C -1.811802 -1.055391 0.684024
C 0.430901 -0.092689 0.680734
C -0.692908 -0.850363 -1.471606
C -0.471325 -1.093851 1.463909
C -1.580780 -1.820103 -0.648780
C -0.001389 1.619295 -1.203935
C -1.968439 1.455385 1.356758
C -3.076450 0.730714 -0.723323
C 2.844059 0.073892 0.126590
H -2.672022 -1.410453 1.259830
H 0.688716 0.794911 1.315096
H 0.256354 -1.308029 -1.779012
H -1.189559 -0.536875 -2.403197
H -0.597488 -0.776302 2.510000
H -0.046139 -2.107692 1.507062
H -2.532885 -2.031954 -1.158165
H -1.092728 -2.791030 -0.484950
H 0.983237 1.470124 -1.665887
H -0.690875 1.949741 -1.988337
H 0.111882 2.450612 -0.494843
H -1.153506 1.358040 2.080808
H -2.905024 1.347593 1.914766
H -1.927347 2.482555 0.975149
H -3.038813 1.761094 -1.095268
H -4.029359 0.602579 -0.198333
H -3.102975 0.077746 -1.600773
H 1.588045 -1.546946 -0.341972
H 4.054553 -1.527196 -0.539803
H 4.821516 -0.026650 -0.464209


%chk=000271888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271888

0 1
O 3.014929 1.202510 0.834791
N 1.734990 -0.623570 0.100616
N 4.070154 -0.594282 -0.209607
C -0.534558 0.374991 -0.588599
C -1.904658 0.436582 0.213013
C -1.796762 -1.058978 0.690377
C 0.451699 -0.079513 0.555925
C -0.769886 -0.858597 -1.519978
C -0.408967 -1.094107 1.396134
C -1.642592 -1.835806 -0.651264
C -0.077616 1.639777 -1.318256
C -1.934017 1.465508 1.370985
C -3.141057 0.727099 -0.673515
C 2.935374 0.064801 0.275717
H -2.630882 -1.411321 1.321554
H 0.728225 0.803855 1.156777
H 0.184077 -1.308255 -1.852921
H -1.297489 -0.551585 -2.441169
H -0.465340 -0.786340 2.454691
H 0.029621 -2.109730 1.379050
H -2.621649 -2.031340 -1.123757
H -1.157420 -2.816810 -0.493393
H 0.896360 1.474167 -1.815638
H -0.804893 1.942944 -2.095062
H 0.057994 2.484765 -0.618397
H -1.127400 1.331410 2.110139
H -2.895364 1.393369 1.914267
H -1.855487 2.495760 0.975855
H -3.123215 1.775014 -1.028187
H -4.069187 0.594780 -0.084995
H -3.214570 0.077287 -1.561279
H 1.739665 -1.549121 -0.329235
H 4.049407 -1.499415 -0.673995
H 4.959611 -0.117649 -0.089344


