%chk=000260037.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260037

0 1
O -3.158056 -0.659790 1.887303
O 6.274348 2.850976 0.650580
O 4.285254 2.278547 0.036012
N -2.897275 -0.124299 -0.329557
N -4.783025 0.419628 -1.719924
N 2.701663 -0.858377 0.113941
N 5.453978 2.023462 0.292253
C -1.454406 -0.295264 -0.226004
C -5.145243 -0.121588 0.651594
C -3.484431 0.242740 -1.575062
C -3.707518 -0.335176 0.858009
C -5.644924 0.248046 -0.619003
C -0.906096 -1.584851 -0.319913
C -0.640283 0.830055 -0.025992
C -6.039718 -0.285939 1.732883
C -2.580472 0.424594 -2.747534
C -7.035394 0.450890 -0.801516
C 1.301651 -0.621474 -0.053957
C 0.474424 -1.748761 -0.227536
C 0.742165 0.666687 0.052118
C -7.397051 -0.085248 1.544488
C -7.891382 0.283737 0.273584
C 5.025070 -0.414035 -0.208024
C 3.590028 -0.140499 -0.490175
C 5.910361 0.624272 0.148651
C 5.522946 -1.721422 -0.310328
C 7.268598 0.353528 0.394750
C 6.872876 -1.987041 -0.069182
C 7.746880 -0.950118 0.280084
H -1.556664 -2.451551 -0.441740
H -1.083168 1.820832 0.080750
H -5.637729 -0.571513 2.709356
H -3.156736 0.663318 -3.660549
H -1.995777 -0.483700 -2.960740
H -1.868814 1.250441 -2.591143
H -7.402384 0.735638 -1.788094
H 0.917431 -2.744409 -0.276609
H 1.385664 1.532901 0.221115
H -8.092027 -0.209629 2.372932
H -8.964247 0.437493 0.145501
H 3.409829 0.686469 -1.203873
H 4.837871 -2.535244 -0.562916
H 7.938954 1.174338 0.678179
H 7.246780 -3.010194 -0.148821
H 8.800150 -1.161969 0.468711


%chk=000260037-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260037

0 1
O -3.157087 -0.649279 1.893334
O 6.747644 2.912817 -0.428252
O 4.650808 2.583448 0.390822
N -2.941703 -0.130723 -0.392309
N -4.835106 0.412114 -1.781801
N 2.687850 -0.943145 0.026950
N 5.799737 2.142057 -0.010458
C -1.501732 -0.317121 -0.281790
C -5.168637 -0.141302 0.618489
C -3.531213 0.239124 -1.626803
C -3.719709 -0.333427 0.806916
C -5.677073 0.221485 -0.669458
C -0.921210 -1.549977 -0.655965
C -0.697788 0.723854 0.234441
C -6.054177 -0.317124 1.713956
C -2.618939 0.452810 -2.810672
C -7.078220 0.402156 -0.836260
C 1.297376 -0.675301 -0.068088
C 0.468744 -1.731552 -0.537097
C 0.694652 0.552499 0.337824
C -7.435265 -0.135922 1.534739
C -7.945094 0.224586 0.254612
C 5.015422 -0.291557 0.046552
C 3.573676 0.017090 -0.097420
C 6.064841 0.678876 0.032824
C 5.410701 -1.657467 0.139322
C 7.429192 0.309311 0.084173
C 6.762722 -2.034973 0.214954
C 7.780643 -1.049004 0.180503
H -1.560531 -2.364435 -1.012133
H -1.169212 1.653461 0.569123
H -5.628924 -0.593863 2.684226
H -3.235555 0.796420 -3.653110
H -2.097508 -0.477164 -3.100048
H -1.839248 1.204562 -2.593339
H -7.446632 0.680425 -1.828137
H 0.939720 -2.682654 -0.802876
H 1.308465 1.351017 0.768966
H -8.121538 -0.270903 2.377299
H -9.023331 0.365299 0.120279
H 3.298166 1.055757 -0.335753
H 4.608337 -2.401181 0.142436
H 8.187219 1.096037 0.056372
H 7.028251 -3.094314 0.293900
H 8.835365 -1.336317 0.233357


