%chk=000213558.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213558

0 1
N 1.362874 0.452291 -0.499449
N -0.863590 -0.003864 0.242482
N -0.031060 2.292275 -0.062198
N -3.125638 -0.277107 0.982353
N -2.379229 1.907253 0.548318
N -1.500681 4.095665 0.363178
C 1.766695 -0.977300 -0.362942
C 2.881398 -1.270797 -1.388358
C 2.219019 -1.297945 1.077269
C 4.228699 -0.642874 -1.010384
C 3.561400 -0.651146 1.433486
C 4.648079 -1.022570 0.415921
C 0.131466 0.909927 -0.076737
C -2.093709 0.546281 0.559144
C -3.089270 -1.742810 0.764904
C -1.300649 2.729439 0.269339
C -3.591714 -2.130766 -0.636584
C -3.660945 -3.645893 -0.792214
H 0.867781 -1.610353 -0.606576
H 2.571061 -0.924223 -2.393537
H 2.994390 -2.370039 -1.469105
H 2.289563 -2.396911 1.189191
H 1.435799 -0.973618 1.791755
H 4.175635 0.458625 -1.105650
H 5.004204 -0.968246 -1.729998
H 3.870357 -0.967020 2.448004
H 3.448772 0.449206 1.482784
H 4.854501 -2.108855 0.468895
H 5.597339 -0.518278 0.676401
H 2.112427 1.140231 -0.593348
H -3.718104 -2.209479 1.555695
H -2.047667 -2.116076 0.915761
H -4.049378 0.151301 1.065522
H -2.912738 -1.700883 -1.402396
H -4.585915 -1.683857 -0.829303
H -2.679336 -4.112776 -0.645811
H -4.353563 -4.099850 -0.074305
H -4.004351 -3.922367 -1.796472
H -2.442457 4.446912 0.444359
H -0.797166 4.718798 -0.002293


%chk=000213558-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213558

0 1
N 1.324163 0.499165 -0.388975
N -0.917923 0.096382 0.216910
N -0.040178 2.363454 -0.070618
N -3.185703 -0.144694 0.812029
N -2.383216 2.029361 0.546991
N -1.487164 4.173318 0.263169
C 1.672539 -0.935512 -0.419528
C 2.800062 -1.180076 -1.453596
C 2.094066 -1.456509 0.984547
C 4.163984 -0.602347 -0.997437
C 3.449114 -0.868234 1.442756
C 4.561406 -1.139157 0.399716
C 0.085002 0.991205 -0.066284
C -2.126111 0.677100 0.511744
C -3.124803 -1.611280 0.776567
C -1.296839 2.811642 0.246220
C -3.402871 -2.207912 -0.625186
C -3.324467 -3.749267 -0.619513
H 0.755903 -1.470032 -0.727649
H 2.503973 -0.760935 -2.434355
H 2.906456 -2.275141 -1.586071
H 2.171733 -2.562602 0.933549
H 1.292500 -1.218276 1.707550
H 4.122692 0.507288 -0.964101
H 4.942280 -0.855509 -1.742804
H 3.732857 -1.294720 2.424085
H 3.342494 0.225724 1.592526
H 4.734907 -2.233386 0.329390
H 5.515865 -0.683246 0.727114
H 2.035098 1.205405 -0.583474
H -3.856993 -2.007124 1.507089
H -2.115358 -1.915452 1.105178
H -4.069128 0.334893 0.988006
H -2.660133 -1.790309 -1.330320
H -4.402095 -1.879736 -0.974150
H -2.321796 -4.094182 -0.303703
H -4.065756 -4.188141 0.075617
H -3.521432 -4.162624 -1.625129
H -2.406180 4.540098 0.493488
H -0.704648 4.783671 0.045753


