%chk=000227438.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227438

0 1
N 0.784942 -2.898062 -0.437474
C -1.637001 -0.994937 0.211356
C -2.644585 -0.397930 -0.792146
C -1.930675 -0.595557 1.672912
C 1.959092 0.049887 -0.344248
C -2.468652 2.135932 -0.322027
C -2.197940 0.977917 -1.302421
C -1.597453 -2.534426 0.078226
C -2.544949 0.797506 1.864185
C -1.849739 1.909688 1.071542
C 2.428899 0.572554 1.028627
C 2.257386 1.086997 -1.447053
C 2.640557 -1.291747 -0.682837
C -0.275932 -3.135131 0.594018
C 1.800479 1.933992 1.347391
C 1.668409 2.465316 -1.118484
C 2.090087 -2.462545 0.154316
C 2.129970 2.962870 0.258111
C -1.919407 3.440490 -0.922651
C 0.955655 -4.080350 -1.328649
H -0.609418 -0.604924 -0.058662
H -3.651882 -0.339062 -0.342732
H -2.747789 -1.075295 -1.663104
H -2.611525 -1.337787 2.134226
H -0.985824 -0.659340 2.246895
H 0.843697 -0.122469 -0.303966
H -3.575048 2.240741 -0.200628
H -1.117814 0.942940 -1.551751
H -2.714528 1.193432 -2.257941
H -1.727043 -2.812446 -0.987444
H -2.447742 -2.991552 0.614670
H -3.620361 0.766154 1.598510
H -2.516500 1.047830 2.943269
H -1.908406 2.853425 1.647488
H -0.760433 1.689028 0.975882
H 2.166489 -0.157275 1.816636
H 3.531524 0.657829 1.042322
H 3.351049 1.178245 -1.587094
H 1.851098 0.730292 -2.411807
H 2.493245 -1.514268 -1.758831
H 3.732744 -1.215550 -0.534251
H 0.002723 -2.653971 1.556069
H -0.419526 -4.212293 0.821751
H 0.692244 1.821191 1.428057
H 2.148223 2.294085 2.331555
H 1.962293 3.190651 -1.899500
H 0.555542 2.423889 -1.143602
H 2.839911 -3.280741 0.186770
H 1.952076 -2.133867 1.207762
H 1.649732 3.930493 0.491999
H 3.219614 3.154991 0.241346
H -0.827765 3.380424 -1.062322
H -2.365654 3.652441 -1.898868
H -2.122902 4.299086 -0.276019
H -0.007269 -4.302544 -1.816295
H 1.307995 -4.993210 -0.826196
H 1.670685 -3.825637 -2.127484


%chk=000227438-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227438

0 1
N 0.711441 -2.420414 -0.362939
C -1.983751 -1.088440 0.095176
C -3.433024 -0.769917 -0.369148
C -1.583063 -0.381094 1.420485
C 2.597495 0.036350 -0.134996
C -3.356095 1.868422 -0.528626
C -3.538239 0.504513 -1.246289
C -1.751502 -2.620111 0.200393
C -2.106389 1.067204 1.609785
C -2.074904 1.966945 0.345989
C 2.735559 0.404613 1.365708
C 3.393826 1.044809 -1.002577
C 3.037504 -1.420494 -0.424263
C -0.297443 -3.023791 0.543907
C 2.310605 1.866294 1.647887
C 2.969547 2.508076 -0.730566
C 2.097440 -2.499005 0.166203
C 3.104248 2.861960 0.769558
C -3.397647 3.015729 -1.566716
C 0.605524 -2.920655 -1.747253
H -1.294642 -0.721825 -0.693899
H -4.113209 -0.691064 0.504326
H -3.807411 -1.624077 -0.970783
H -1.935848 -0.992766 2.278852
H -0.476464 -0.372482 1.476556
H 1.523202 0.114709 -0.407789
H -4.219656 2.000649 0.160728
H -2.782558 0.427368 -2.057785
H -4.528515 0.518446 -1.747909
H -2.058361 -3.100347 -0.750780
H -2.413176 -3.044641 0.985015
H -3.149014 1.043074 1.987566
H -1.506606 1.540301 2.413574
H -1.969268 3.024288 0.664135
H -1.178071 1.738507 -0.267857
H 2.130251 -0.282996 1.988423
H 3.795449 0.266723 1.671956
H 4.478817 0.933239 -0.787135
H 3.256647 0.802861 -2.076124
H 3.123497 -1.562790 -1.521051
H 4.055840 -1.589603 -0.013605
H -0.063445 -2.685322 1.570508
H -0.229540 -4.144162 0.550594
H 1.226576 1.977066 1.433627
H 2.450827 2.104494 2.720762
H 3.575115 3.203208 -1.344851
H 1.911765 2.642866 -1.040117
H 2.546704 -3.510852 -0.010805
H 2.043884 -2.368964 1.263676
H 2.756999 3.897771 0.952600
H 4.176146 2.826073 1.056511
H -2.525503 2.960001 -2.247197
H -4.311334 2.964647 -2.188887
H -3.376724 4.005725 -1.073571
H -0.398059 -2.711753 -2.155189
H 0.788689 -4.023838 -1.823428
H 1.338462 -2.408132 -2.392964


