%chk=000281036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281036

0 1
N 0.575541 -1.663487 -0.598999
N 0.177182 0.422596 0.697754
C -1.512612 -1.287862 0.793625
C 1.377713 -1.068968 -1.707493
C 1.261659 -2.810188 0.067867
C 2.877864 -0.864073 -1.437097
C 2.715866 -2.508778 0.462138
C 3.519461 -2.086860 -0.773226
C -0.121053 -0.767549 0.303405
C -2.562154 -0.389279 0.132938
C -1.513509 -1.215300 2.329296
C -1.826950 -2.734098 0.374267
C -2.572485 -0.287122 -1.270650
C -3.520881 0.313918 0.871814
C 1.301692 1.243167 0.462412
C -3.525138 0.500585 -1.917088
C -4.475787 1.103788 0.220407
C -4.482588 1.199131 -1.172440
C 1.274863 2.185980 -0.587071
C 2.376477 1.228147 1.376422
C 2.324239 3.094798 -0.716737
C 3.414086 2.148667 1.227132
C 3.397718 3.077071 0.181041
H 0.914668 -0.108707 -2.020846
H 1.255288 -1.774999 -2.563414
H 1.232274 -3.658684 -0.654046
H 0.677629 -3.127461 0.959403
H 3.039881 0.028621 -0.800828
H 3.389626 -0.637749 -2.391757
H 3.170660 -3.398392 0.933854
H 2.746594 -1.705208 1.223717
H 3.576022 -2.925762 -1.493096
H 4.563219 -1.856101 -0.488273
H -0.701029 -1.811071 2.757317
H -1.372458 -0.182034 2.681152
H -2.453452 -1.588552 2.749007
H -1.194959 -3.459747 0.897333
H -1.679880 -2.888521 -0.702957
H -2.871469 -2.980132 0.599979
H -1.829292 -0.827211 -1.857631
H -3.532497 0.264113 1.958900
H -3.523586 0.572689 -3.002870
H -5.213778 1.648205 0.806772
H -5.224447 1.813865 -1.676263
H 0.428124 2.215018 -1.268834
H 2.381928 0.516495 2.197170
H 2.305205 3.827280 -1.523049
H 4.243357 2.143604 1.933560
H 4.211269 3.788656 0.071081


%chk=000281036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281036

0 1
N 0.708694 -1.309017 -0.322143
N 0.128930 0.677725 0.914723
C -1.469548 -1.136272 1.096576
C 1.283918 -0.660368 -1.531839
C 1.119771 -2.722562 -0.155499
C 2.819494 -0.790988 -1.636019
C 2.663036 -2.860227 -0.185844
C 3.251753 -2.267646 -1.485162
C -0.082646 -0.576949 0.590626
C -2.497175 -0.540171 0.089041
C -1.704127 -0.644471 2.546907
C -1.661451 -2.680146 1.100563
C -2.499964 -0.984741 -1.261564
C -3.438218 0.449992 0.465217
C 1.299392 1.443647 0.751870
C -3.417267 -0.465836 -2.200277
C -4.362466 0.968562 -0.470836
C -4.358625 0.514053 -1.808297
C 1.245934 2.683826 0.051465
C 2.514783 1.085268 1.410318
C 2.380325 3.519338 -0.014019
C 3.637532 1.938150 1.356004
C 3.584811 3.155532 0.635953
H 0.978961 0.396384 -1.549809
H 0.824769 -1.155160 -2.418429
H 0.690233 -3.347302 -0.971815
H 0.740115 -3.106321 0.800758
H 3.292407 -0.176861 -0.848615
H 3.146533 -0.387525 -2.613881
H 2.925415 -3.931920 -0.087862
H 3.089107 -2.330965 0.689450
H 2.885282 -2.855076 -2.353574
H 4.354773 -2.350149 -1.483977
H -0.969697 -1.119547 3.222813
H -1.567324 0.444997 2.623446
H -2.716429 -0.920928 2.895591
H -1.031702 -3.169262 1.866127
H -1.463021 -3.149868 0.124475
H -2.715475 -2.891043 1.357185
H -1.773138 -1.738558 -1.586298
H -3.453136 0.829289 1.490603
H -3.397961 -0.825468 -3.235697
H -5.083184 1.731223 -0.153499
H -5.074477 0.917273 -2.533495
H 0.303136 2.977064 -0.423160
H 2.552654 0.151943 1.983946
H 2.319926 4.466408 -0.563229
H 4.556666 1.652560 1.881730
H 4.458778 3.814616 0.594547


