%chk=000256485.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256485

0 1
N 4.043118 1.290680 0.752989
C 0.395352 0.469741 -0.311565
C -0.882716 0.686422 0.546912
C 0.528475 -1.005775 -0.766677
C 1.604551 0.901784 0.563581
C 0.325605 1.362675 -1.566888
C -2.186788 0.277347 -0.148358
C 0.604885 -2.018875 0.382473
C 2.965829 0.745102 -0.128874
C -3.407638 0.569800 0.736207
C 0.753461 -3.448224 -0.136479
C -4.710440 0.158166 0.053782
H -0.942254 1.753919 0.835837
H -0.784408 0.125826 1.496394
H -0.328071 -1.259915 -1.421388
H 1.424121 -1.109723 -1.408754
H 1.480430 1.962929 0.863748
H 1.599276 0.325852 1.508406
H 0.268094 2.422711 -1.296976
H 1.205969 1.237960 -2.204802
H -0.556418 1.133578 -2.174379
H -2.159377 -0.800002 -0.403135
H -2.286832 0.812833 -1.112563
H -0.304500 -1.944632 1.011527
H 1.455223 -1.774380 1.048513
H 3.131842 -0.317204 -0.411660
H 2.982723 1.336740 -1.072522
H -3.308526 0.038668 1.702885
H -3.441901 1.648161 0.986496
H 1.663640 -3.569551 -0.734011
H -0.093416 -3.737527 -0.769053
H 0.804652 -4.165662 0.689923
H -4.725709 -0.913737 -0.173532
H -4.858606 0.695127 -0.889959
H -5.575701 0.370810 0.691385
H 4.955513 1.096006 0.352327
H 4.021341 0.846071 1.665288


%chk=000256485-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000256485

0 1
N 4.023517 1.287126 0.901215
C 0.407377 0.465707 -0.360102
C -0.888761 0.700335 0.489114
C 0.538325 -1.028873 -0.800381
C 1.607925 0.918717 0.534348
C 0.353357 1.346092 -1.639386
C -2.232098 0.255468 -0.132980
C 0.663671 -2.074991 0.331234
C 3.025172 0.751567 -0.052551
C -3.444150 0.640434 0.747839
C 0.765921 -3.515922 -0.216068
C -4.792469 0.182508 0.151295
H -0.948315 1.785679 0.719398
H -0.772648 0.190900 1.468906
H -0.339243 -1.289567 -1.427026
H 1.418806 -1.127019 -1.469121
H 1.480931 1.990174 0.787772
H 1.563071 0.367162 1.498057
H 0.265213 2.417938 -1.378033
H 1.263933 1.219536 -2.253512
H -0.509385 1.077990 -2.276235
H -2.237365 -0.843154 -0.284096
H -2.364035 0.710089 -1.135501
H -0.209014 -2.004769 1.010611
H 1.557720 -1.855304 0.947896
H 3.196045 -0.320058 -0.317493
H 3.113368 1.333460 -0.988961
H -3.315623 0.199615 1.757903
H -3.455186 1.740592 0.889699
H 1.652848 -3.630665 -0.867870
H -0.125650 -3.774688 -0.818419
H 0.848561 -4.256552 0.600879
H -4.819645 -0.917101 0.030157
H -4.957444 0.632444 -0.846223
H -5.642084 0.472311 0.796866
H 4.980634 1.319364 0.535084
H 3.987517 0.837155 1.822784


