%chk=000280419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280419

0 1
O -3.898149 0.020168 -1.241538
N -1.270070 0.344014 -0.473421
N -2.252197 0.058111 0.463165
N -4.567350 -0.195339 0.945373
C 2.727119 -0.034152 0.381737
C 2.045946 -0.267203 -1.016913
C 2.010784 1.243976 0.919985
C 1.031515 0.915309 -1.118764
C 1.822282 2.052285 -0.401981
C 2.546141 -1.324910 1.192426
C 1.441023 -1.676783 -1.005469
C 0.531733 0.919610 1.280692
C -0.080492 0.676009 -0.092560
C 1.518126 -2.195282 0.442991
C -3.583795 -0.030791 -0.074651
H 3.806378 0.186695 0.260419
H 2.783850 -0.174335 -1.838057
H 2.555709 1.753610 1.721152
H 0.677399 1.124668 -2.136165
H 2.760999 2.317394 -0.901789
H 1.248938 2.978952 -0.279376
H 2.224696 -1.121410 2.226481
H 3.510262 -1.857825 1.273393
H 2.003151 -2.340215 -1.685116
H 0.398921 -1.677580 -1.374958
H 0.052921 1.766302 1.797939
H 0.443986 0.039361 1.937139
H 0.526172 -2.125293 0.923358
H 1.800954 -3.259895 0.470562
H -2.149099 0.418731 1.421511
H -5.489460 -0.452656 0.605340
H -4.329492 -0.656525 1.810095


%chk=000280419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280419

0 1
O -3.898745 -0.490934 -1.192552
N -1.268637 0.363144 -0.596367
N -2.247890 0.160608 0.376309
N -4.429862 -0.314277 1.072048
C 2.694682 -0.044789 0.433573
C 2.099598 -0.233242 -1.024555
C 1.962379 1.239943 0.954600
C 1.075806 0.958117 -1.138625
C 1.852141 2.070735 -0.363447
C 2.454828 -1.392066 1.173960
C 1.532041 -1.676789 -1.095001
C 0.458070 0.946622 1.244056
C -0.076351 0.708642 -0.180457
C 1.340470 -2.133421 0.378965
C -3.548650 -0.230875 -0.013742
H 3.776656 0.182342 0.395698
H 2.872984 -0.077537 -1.800158
H 2.477340 1.730409 1.797124
H 0.752460 1.174999 -2.166776
H 2.834539 2.297763 -0.814271
H 1.279225 3.008165 -0.246662
H 2.198666 -1.254259 2.242009
H 3.383792 -1.993221 1.145861
H 2.262785 -2.338010 -1.598622
H 0.589033 -1.724096 -1.668684
H -0.022755 1.831288 1.712970
H 0.305157 0.086035 1.923325
H 0.336137 -1.840964 0.736444
H 1.410944 -3.230993 0.488526
H -2.029451 0.289733 1.373127
H -5.378619 -0.612205 0.860563
H -4.199872 -0.035866 2.023760


