%chk=000253501.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253501

0 1
N -0.205849 -2.604687 0.082601
N 1.585560 1.871538 0.020839
N 0.584302 -0.323196 0.063978
N 3.013317 0.024592 0.064545
N 2.100847 -2.252803 0.077594
N 4.430504 -1.887125 0.252765
N 5.596977 -1.116649 0.007981
C -1.614339 -2.331144 0.062458
C 0.376729 2.644567 -0.005471
C 0.831082 -1.684289 0.080481
C 1.701175 0.489087 0.048473
C -2.440885 -3.353220 -0.452454
C -2.174841 -1.147038 0.565585
C 0.470543 3.965265 0.484299
C -0.832771 2.163021 -0.529460
C 3.147895 -1.352344 0.104934
C -3.823682 -3.173029 -0.461061
C -3.562520 -0.987570 0.542709
C -0.654523 4.788457 0.446549
C -1.947300 3.004928 -0.553152
C -4.389607 -1.992459 0.033142
C -1.865553 4.313662 -0.069251
H 0.074765 -3.593953 0.036919
H 2.467614 2.395893 0.085899
H -2.012816 -4.271971 -0.846653
H -1.542432 -0.352326 0.971872
H 1.403340 4.343514 0.895689
H -0.913835 1.142450 -0.914623
H -4.465948 -3.958670 -0.858592
H -3.999982 -0.068142 0.932489
H -0.587586 5.808345 0.824882
H -2.888275 2.632416 -0.958814
H -5.468821 -1.858875 0.021510
H -2.738929 4.961226 -0.093662
H 4.568120 -2.882627 0.027058
H 5.757349 -0.507506 0.825150
H 5.471475 -0.476040 -0.790407


%chk=000253501-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253501

0 1
N -0.226986 -2.567706 -0.117864
N 1.538100 1.866816 0.168650
N 0.533888 -0.300603 0.025362
N 2.953361 0.046272 0.126344
N 2.050522 -2.214016 -0.052433
N 4.353474 -1.848004 0.048236
N 5.541235 -1.086606 0.130333
C -1.637330 -2.423123 -0.051154
C 0.416035 2.732655 0.087614
C 0.800530 -1.645690 -0.040646
C 1.648184 0.490369 0.099217
C -2.416534 -3.562859 -0.396567
C -2.290359 -1.234523 0.370535
C 0.632272 4.096959 0.429982
C -0.871239 2.318094 -0.345694
C 3.081669 -1.313773 0.040464
C -3.822757 -3.514111 -0.324762
C -3.699859 -1.200677 0.434570
C -0.420277 5.029552 0.343853
C -1.915962 3.263834 -0.424166
C -4.477132 -2.329794 0.088706
C -1.705733 4.619234 -0.081491
H 0.130213 -3.520567 -0.230667
H 2.451726 2.312556 0.289379
H -1.917636 -4.483953 -0.724459
H -1.691905 -0.366323 0.648124
H 1.624854 4.422756 0.766999
H -1.031939 1.275271 -0.620743
H -4.406877 -4.400952 -0.594692
H -4.191980 -0.279454 0.767174
H -0.236378 6.075862 0.611969
H -2.903699 2.933355 -0.765578
H -5.570130 -2.291021 0.143194
H -2.524651 5.343207 -0.147291
H 4.449354 -2.861224 -0.016486
H 5.579979 -0.560030 1.014039
H 5.625066 -0.448485 -0.673251


