%chk=000261699.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261699

0 1
S -5.092510 -0.635338 -1.043357
C -0.498403 -0.000129 0.185089
C -1.546969 1.045735 -0.368385
C -1.631125 -0.833860 0.903707
C -2.532279 0.131108 -1.164075
C -2.584057 -1.176958 -0.284660
C -2.246366 1.521996 0.933063
C -2.309618 0.237111 1.799538
C 0.540226 0.584797 1.167024
C 0.259561 -0.731896 -0.943413
C -3.918656 0.707422 -1.408329
C -4.008082 -1.551120 0.096845
C 1.339239 1.722131 0.591624
C 1.245680 -1.786534 -0.519260
C 2.612804 1.493306 0.047590
C 2.507818 -1.826744 -1.138763
C 0.831295 3.031362 0.620668
C 0.927018 -2.763218 0.436193
C 3.358427 2.555415 -0.470336
C 3.431031 -2.818061 -0.799622
C 1.579317 4.090067 0.101636
C 1.853804 -3.752561 0.774264
C 2.844184 3.855461 -0.447407
C 3.108725 -3.783656 0.159433
H -1.123605 1.858683 -0.968444
H -1.281743 -1.720190 1.451369
H -2.074765 -0.116155 -2.150251
H -2.139346 -2.018760 -0.865909
H -3.250427 1.932478 0.732971
H -1.668779 2.325408 1.421648
H -1.777260 0.358934 2.754946
H -3.347926 -0.037932 2.051070
H 1.217924 -0.233243 1.495651
H 0.053292 0.919507 2.106283
H 0.777505 0.048963 -1.545396
H -0.446328 -1.211400 -1.656479
H -4.138254 1.577974 -0.758696
H -4.064002 1.034289 -2.451956
H -4.206644 -2.630776 -0.013478
H -4.254777 -1.277175 1.141660
H 3.023923 0.484279 0.034102
H 2.768817 -1.084488 -1.891077
H -0.153988 3.218662 1.051596
H -0.050575 -2.751224 0.923020
H 4.345404 2.369246 -0.890407
H 4.405415 -2.839415 -1.285374
H 1.177522 5.101456 0.126913
H 1.595136 -4.503746 1.518906
H 3.426072 4.680555 -0.850706
H 3.828844 -4.554369 0.423072


%chk=000261699-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261699

0 1
S -5.161045 -1.125700 -1.143739
C -0.561659 0.105997 0.187413
C -1.704957 1.073713 -0.342185
C -1.609167 -0.777519 0.989811
C -2.675339 0.069292 -1.060098
C -2.584023 -1.230382 -0.148501
C -2.350299 1.566625 0.984190
C -2.316278 0.282794 1.890240
C 0.498297 0.758148 1.142990
C 0.208236 -0.605178 -0.979998
C -4.150336 0.478497 -1.266996
C -3.994553 -1.733777 0.228632
C 1.430683 1.812600 0.547266
C 1.188856 -1.716525 -0.605140
C 2.831076 1.582862 0.494505
C 2.572187 -1.577037 -0.894098
C 0.951275 3.074261 0.098822
C 0.753579 -2.944229 -0.034787
C 3.719655 2.562462 -0.004164
C 3.491454 -2.612365 -0.609962
C 1.833753 4.055622 -0.404664
C 1.667722 -3.981368 0.254691
C 3.223891 3.803698 -0.463439
C 3.043919 -3.819716 -0.027540
H -1.363084 1.882126 -1.009361
H -1.177372 -1.612172 1.566672
H -2.271029 -0.165792 -2.061264
H -2.104712 -2.036884 -0.733129
H -3.373203 1.953721 0.843742
H -1.766229 2.392146 1.428298
H -1.753313 0.452873 2.824701
H -3.327268 -0.036316 2.194519
H 1.114430 -0.068460 1.545750
H -0.014107 1.204715 2.012613
H 0.764542 0.185036 -1.519976
H -0.509865 -1.019132 -1.708915
H -4.526547 1.174571 -0.500936
H -4.340218 0.906605 -2.264290
H -4.064743 -2.833236 0.246531
H -4.362942 -1.338077 1.188767
H 3.227142 0.627832 0.859314
H 2.927906 -0.648379 -1.355485
H -0.117704 3.304170 0.160995
H -0.311084 -3.103226 0.166759
H 4.796459 2.358722 -0.027929
H 4.552873 -2.478338 -0.848731
H 1.438035 5.020975 -0.741263
H 1.305317 -4.919614 0.690651
H 3.909289 4.566313 -0.849910
H 3.752995 -4.625555 0.192729


