%chk=000207408.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207408

0 1
S -3.826491 -4.454440 -0.811419
S -2.178610 5.727051 -0.587527
S 5.710208 -0.578490 -1.609019
P 0.099532 0.088291 1.410298
C -0.991564 -1.240030 0.665018
C -0.610603 1.684270 0.735117
C 1.721874 -0.105121 0.493058
C -0.599103 -2.000986 -0.434867
C -1.689553 1.708997 -0.146793
C 2.092779 0.732740 -0.562208
C -2.219534 -1.474874 1.293998
C -0.041542 2.875748 1.200093
C 2.580891 -1.110560 0.939586
C -1.442948 -3.009563 -0.922210
C -2.210061 2.937865 -0.578163
C 3.335107 0.561922 -1.180022
C -3.066480 -2.475292 0.809582
C -0.553011 4.102660 0.769746
C 3.824664 -1.291424 0.318553
C -2.668395 -3.236207 -0.298076
C -1.637310 4.122244 -0.118350
C 4.191028 -0.453470 -0.734017
C -3.053054 -5.343485 -2.176645
C -3.629761 5.485445 -1.630750
C 6.695135 -1.810968 -0.735082
H 0.357276 -1.835595 -0.937588
H -2.150000 0.790711 -0.520049
H 1.434872 1.528100 -0.922289
H -2.541493 -0.895466 2.162847
H 0.799670 2.878162 1.897610
H 2.314551 -1.771887 1.767587
H -1.125639 -3.596486 -1.781005
H -3.052042 2.943838 -1.266497
H 3.626247 1.219322 -1.999909
H -4.023734 -2.658187 1.298650
H -0.109296 5.031041 1.130754
H 4.483784 -2.081520 0.670590
H -3.756982 -6.127784 -2.491332
H -2.861946 -4.695616 -3.039354
H -2.117710 -5.830369 -1.878262
H -3.999963 6.484015 -1.905383
H -3.392006 4.947573 -2.555219
H -4.435682 4.960028 -1.105929
H 6.244557 -2.808698 -0.776706
H 7.672420 -1.858900 -1.237333
H 6.868017 -1.537701 0.312115


%chk=000207408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207408

0 1
S -3.933430 -4.501946 -0.806723
S -2.252820 5.787306 -0.576336
S 5.722457 -0.596168 -1.806092
P 0.136314 0.064082 1.595863
C -0.972281 -1.246526 0.804430
C -0.593140 1.652558 0.874076
C 1.719516 -0.113273 0.578796
C -0.646693 -1.957438 -0.374478
C -1.571206 1.686227 -0.147445
C 1.977206 0.598222 -0.621109
C -2.190960 -1.561317 1.465256
C -0.156037 2.886088 1.429035
C 2.718940 -0.991152 1.067944
C -1.511214 -2.950780 -0.890982
C -2.100840 2.913088 -0.611511
C 3.194367 0.432603 -1.313202
C -3.064757 -2.540150 0.953074
C -0.667615 4.113673 0.965676
C 3.937400 -1.173897 0.376371
C -2.728367 -3.244758 -0.233426
C -1.649587 4.134963 -0.060440
C 4.182521 -0.459731 -0.820950
C -3.112372 -5.179441 -2.351645
C -3.546432 5.365832 -1.867608
C 6.734229 -1.826711 -0.815584
H 0.291552 -1.745342 -0.898879
H -1.933706 0.750643 -0.587471
H 1.228182 1.294275 -1.014262
H -2.460320 -1.037776 2.390444
H 0.589349 2.888488 2.233363
H 2.549416 -1.539587 2.002468
H -1.220221 -3.480242 -1.803668
H -2.859005 2.895014 -1.400479
H 3.375498 0.997493 -2.234931
H -4.000863 -2.762425 1.477991
H -0.313663 5.052233 1.407289
H 4.681718 -1.863427 0.786587
H -3.804849 -5.943170 -2.737811
H -2.982585 -4.386553 -3.104824
H -2.146872 -5.649030 -2.106760
H -3.953876 6.334037 -2.197081
H -3.090026 4.848666 -2.726050
H -4.352889 4.758472 -1.427766
H 6.224024 -2.801209 -0.763401
H 7.679980 -1.936683 -1.368206
H 6.942056 -1.438325 0.193661


