%chk=000258140.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258140

0 1
N 2.210765 0.542431 -0.005036
N 1.343872 3.242260 -0.103842
N -0.055876 -0.164558 -0.039551
N -1.866518 1.559101 -0.087779
N -2.289198 -0.838415 -0.025738
C 3.137198 1.589943 -0.064306
C 0.811888 0.823830 -0.040038
C 2.647816 -0.849034 0.114209
C 2.688285 2.915652 -0.103699
C 0.467622 2.261372 -0.078760
C 4.587252 1.251081 -0.079862
C 3.635264 4.070691 -0.148399
C 3.229398 -1.278816 1.316859
C 2.460128 -1.722634 -0.965791
C -0.995152 2.514050 -0.092373
C -1.460928 0.154048 -0.056699
C 3.647136 -2.607422 1.422759
C 2.882725 -3.048952 -0.836921
C 3.479014 -3.489275 0.349025
C -3.709262 -0.759931 -0.054957
C -4.427100 0.062584 -0.944067
C -4.394249 -1.653358 0.796000
C -5.820647 -0.015120 -0.977923
C -5.786586 -1.709662 0.752726
C -6.502924 -0.895335 -0.132524
H 5.016257 1.298670 0.935016
H 5.161356 1.954624 -0.705457
H 4.805182 0.244549 -0.473180
H 4.338720 4.054304 0.694619
H 3.093367 5.031340 -0.093676
H 4.210359 4.086927 -1.084549
H 3.335893 -0.596909 2.158559
H 1.961291 -1.384052 -1.874771
H -1.319815 3.566518 -0.110874
H 4.095215 -2.959919 2.351660
H 2.732536 -3.743957 -1.663766
H 3.801159 -4.526020 0.442522
H -3.897742 0.758171 -1.592891
H -3.829300 -2.291675 1.474303
H -6.377818 0.618963 -1.665697
H -6.319026 -2.394436 1.410840
H -7.588253 -0.947827 -0.161974


%chk=000258140-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258140

0 1
N 2.227380 0.577688 -0.028505
N 1.420835 3.282577 -0.335517
N -0.062309 -0.095786 -0.023100
N -1.844182 1.628844 -0.183998
N -2.291229 -0.761402 -0.028355
C 3.184453 1.593714 -0.159080
C 0.829479 0.878623 -0.099111
C 2.620222 -0.808252 0.210005
C 2.764464 2.933654 -0.307696
C 0.512347 2.292166 -0.240496
C 4.640129 1.199113 -0.151725
C 3.747075 4.079137 -0.445901
C 3.117797 -1.176256 1.478741
C 2.471738 -1.764056 -0.817457
C -0.914803 2.569200 -0.263347
C -1.437819 0.249511 -0.078604
C 3.497175 -2.516611 1.712834
C 2.853179 -3.101442 -0.576514
C 3.370294 -3.479037 0.685018
C -3.696480 -0.723995 -0.058443
C -4.551605 0.425351 -0.139350
C -4.309673 -2.015972 0.005183
C -5.951321 0.265438 -0.154175
C -5.709143 -2.164470 -0.011234
C -6.541277 -1.021436 -0.091235
H 5.004896 0.995190 0.872463
H 5.257101 2.005396 -0.573855
H 4.807636 0.278616 -0.737150
H 4.476866 4.113593 0.383386
H 3.175053 5.019717 -0.444684
H 4.318453 4.030148 -1.392684
H 3.183310 -0.429487 2.277478
H 2.042496 -1.468092 -1.779064
H -1.230998 3.616854 -0.348706
H 3.877852 -2.808702 2.697275
H 2.734178 -3.848960 -1.367698
H 3.658848 -4.519341 0.869856
H -4.095490 1.415842 -0.188256
H -3.641378 -2.880578 0.068443
H -6.591854 1.153505 -0.215695
H -6.152584 -3.165477 0.038944
H -7.631806 -1.130723 -0.103993


