%chk=000224608.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224608

0 1
N -4.357127 -0.645278 -0.112796
N 0.580806 1.302706 -0.146799
N 3.708210 -1.730113 0.400148
N 4.980950 0.317550 0.885256
N 5.832151 -1.826131 1.447173
C -1.716103 2.132669 0.178127
C -0.371793 2.381872 -0.544766
C -2.407093 0.863832 -0.332432
C -3.737560 0.621293 0.400873
C 0.142544 3.797100 -0.222363
C -5.017961 -0.419252 -1.442335
C -5.321432 -1.223694 0.881723
C 1.824520 1.268780 -0.981722
C 2.870339 0.429691 -0.308392
C -5.214198 -1.754446 -2.162656
C -4.555299 -1.865626 2.039886
C 2.749409 -0.983779 -0.211255
C 4.004052 1.024771 0.268110
C 1.583368 -1.726203 -0.762517
C 4.809042 -1.060159 0.912667
H -2.375139 3.008994 0.029179
H -1.552529 2.060088 1.270279
H -0.533142 2.301699 -1.651689
H -2.575535 0.927968 -1.424454
H -1.741631 -0.014970 -0.193357
H -4.405674 1.502096 0.298872
H -3.536293 0.503712 1.488949
H 0.823970 1.382683 0.845489
H 0.273662 3.950222 0.853692
H 1.107384 3.993819 -0.701586
H -0.554816 4.563616 -0.576079
H -4.349676 0.227692 -2.055872
H -5.987291 0.117080 -1.357542
H -5.922076 -2.007783 0.367279
H -6.044392 -0.473881 1.268533
H 1.549112 0.823187 -1.966973
H 2.226692 2.284004 -1.203628
H -4.275717 -2.326039 -2.182045
H -5.958351 -2.384893 -1.663235
H -5.538886 -1.601094 -3.196032
H -3.788396 -2.556156 1.661747
H -4.034444 -1.119899 2.650971
H -5.227330 -2.430082 2.692850
H 4.151235 2.112932 0.246434
H 1.561254 -2.777690 -0.435550
H 0.630957 -1.256576 -0.451420
H 1.595468 -1.724851 -1.862161
H 6.551590 -1.368337 1.985758
H 5.658971 -2.801525 1.638161


%chk=000224608-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224608

0 1
N -4.269894 -0.697972 -0.039177
N 0.641961 1.609086 -0.107415
N 3.418706 -1.837511 0.314841
N 4.782387 -0.041011 1.283616
N 5.257092 -2.303311 1.691609
C -1.743924 2.266459 -0.064023
C -0.357923 2.537265 -0.700871
C -2.328903 0.879176 -0.406658
C -3.628338 0.580806 0.370170
C 0.023422 4.038898 -0.576795
C -5.062382 -0.554970 -1.290470
C -5.043174 -1.332529 1.062447
C 1.970622 1.549979 -0.767512
C 2.851474 0.490032 -0.135529
C -5.222373 -1.880659 -2.059595
C -4.142121 -2.037744 2.094770
C 2.617172 -0.913877 -0.291854
C 3.960374 0.851825 0.663881
C 1.490026 -1.443873 -1.145425
C 4.462192 -1.362904 1.078166
H -2.445144 3.060281 -0.393141
H -1.651984 2.373473 1.039401
H -0.418298 2.281096 -1.780195
H -2.521049 0.824528 -1.497514
H -1.584026 0.096560 -0.177136
H -4.338144 1.443047 0.263904
H -3.381939 0.515863 1.446804
H 0.733224 1.747522 0.909930
H 0.036079 4.349708 0.486079
H 1.021302 4.244208 -1.005805
H -0.707172 4.677631 -1.107841
H -4.533444 0.164777 -1.942227
H -6.071020 -0.110685 -1.085763
H -5.715956 -2.086588 0.614714
H -5.703235 -0.588963 1.579364
H 1.792429 1.316417 -1.836756
H 2.522509 2.521630 -0.745750
H -4.229835 -2.295328 -2.307555
H -5.768085 -2.638890 -1.469070
H -5.786187 -1.718829 -2.997676
H -3.541426 -2.820038 1.599248
H -3.442678 -1.333350 2.580949
H -4.753344 -2.506268 2.889179
H 4.208494 1.910094 0.818664
H 1.354095 -2.519880 -0.957869
H 0.556660 -0.894602 -0.932053
H 1.717657 -1.306072 -2.220990
H 6.040310 -1.994033 2.260369
H 5.049611 -3.288870 1.557060


