%chk=000256484.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256484

0 1
N 3.536872 -0.179464 -0.766718
C -0.207975 0.290326 0.157365
C -1.378110 0.501528 -0.843195
C -0.410068 -1.021582 0.965863
C 1.097507 0.225727 -0.679453
C -0.146949 1.454859 1.184404
C -2.761875 0.593823 -0.188997
C -0.467856 -2.289734 0.105733
C 2.369724 0.020061 0.158396
C 0.064247 2.840194 0.560083
C -3.864029 0.798800 -1.238607
C -0.679814 -3.542372 0.968337
C 0.110582 3.935864 1.623977
C -5.246072 0.890918 -0.595046
C -0.731930 -4.809707 0.117506
C 4.668712 -0.832452 -0.041614
C 3.987489 1.117980 -1.353760
H -1.376525 -0.327383 -1.578359
H -1.190019 1.420690 -1.431395
H -1.341990 -0.939660 1.558871
H 0.406524 -1.120935 1.707026
H 1.195899 1.149365 -1.281888
H 1.025121 -0.597432 -1.420244
H -1.082661 1.463535 1.777163
H 0.661450 1.257065 1.913922
H -2.967194 -0.325374 0.393842
H -2.781629 1.426018 0.541340
H -1.283090 -2.205967 -0.639097
H 0.466746 -2.392799 -0.481182
H 2.513123 0.867719 0.861155
H 2.254522 -0.894888 0.781100
H -0.748883 3.056084 -0.161415
H 1.003369 2.851552 -0.027542
H -3.662117 1.717804 -1.822531
H -3.847387 -0.033168 -1.969428
H 0.133499 -3.627807 1.714905
H -1.616541 -3.445018 1.550798
H -0.821220 3.979300 2.199034
H 0.261322 4.921388 1.169885
H 0.927082 3.773763 2.336201
H -5.308622 1.729452 0.107621
H -6.025849 1.036679 -1.350660
H -5.493511 -0.020803 -0.039600
H -1.553211 -4.775115 -0.607231
H -0.879196 -5.699338 0.739339
H 0.196122 -4.953345 -0.447871
H 4.342963 -1.825724 0.306654
H 5.055859 -0.269968 0.819799
H 5.498679 -0.997331 -0.747120
H 3.149075 1.571713 -1.906702
H 4.787585 0.920208 -2.084409
H 4.357050 1.853352 -0.624755


%chk=000256484-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256484

0 1
N 3.589329 -0.212139 -0.759090
C -0.197428 0.297514 0.190525
C -1.369262 0.541021 -0.819078
C -0.403238 -1.047037 0.967424
C 1.115449 0.264553 -0.661752
C -0.136355 1.433951 1.267412
C -2.801487 0.606601 -0.241954
C -0.475178 -2.343210 0.128436
C 2.435080 0.106255 0.122085
C 0.056052 2.879449 0.753737
C -3.863450 0.840697 -1.342285
C -0.726444 -3.594862 1.001779
C 0.167035 3.896045 1.911855
C -5.302765 0.914986 -0.788928
C -0.794938 -4.900156 0.180049
C 4.777910 -0.604175 0.025817
C 3.908146 0.867982 -1.714922
H -1.337265 -0.256874 -1.589581
H -1.170462 1.486163 -1.366113
H -1.333560 -0.963512 1.566693
H 0.412482 -1.156739 1.712604
H 1.151879 1.193222 -1.264501
H 1.058253 -0.570180 -1.387111
H -1.064163 1.398352 1.875603
H 0.688196 1.201846 1.973425
H -3.044934 -0.333896 0.292266
H -2.877389 1.421044 0.506811
H -1.285318 -2.266881 -0.625216
H 0.467323 -2.485750 -0.437330
H 2.635524 1.031221 0.726044
H 2.340538 -0.730813 0.839787
H -0.790516 3.165427 0.099116
H 0.969838 2.941461 0.129720
H -3.624950 1.778735 -1.884767
H -3.794833 0.024957 -2.091120
H 0.078156 -3.676736 1.761538
H -1.672315 -3.461393 1.566420
H -0.741758 3.880758 2.543308
H 0.299762 4.927347 1.535698
H 1.029615 3.659450 2.563504
H -5.406543 1.743912 -0.063319
H -6.040231 1.078933 -1.596329
H -5.575796 -0.021862 -0.267192
H -1.612781 -4.857156 -0.564087
H -0.972898 -5.778920 0.827190
H 0.149270 -5.071034 -0.370822
H 4.528888 -1.463518 0.674177
H 5.172784 0.217368 0.678662
H 5.589808 -0.914704 -0.656584
H 3.051970 1.053992 -2.384216
H 4.765126 0.561822 -2.341478
H 4.174644 1.834884 -1.212415


