%chk=000224226.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224226

0 1
Br -0.464972 -1.333734 2.990419
Si 0.506931 -0.007514 0.244906
C -0.708152 0.168781 1.707448
C 2.247727 -0.226627 0.897391
C 0.055634 -1.467338 -0.830119
C 0.412278 1.594511 -0.718035
C -2.142201 0.264956 1.305936
C 3.199535 -0.826590 0.053159
C 0.229389 -2.767022 -0.320097
C 1.565218 2.363786 -0.944113
C 2.650486 0.208412 2.169666
C -0.448927 -1.312241 -2.130779
C -0.814531 2.044924 -1.237340
C -2.821862 1.486088 1.471349
C -2.830294 -0.834638 0.762011
C 4.524453 -0.985042 0.473056
C -0.104810 -3.884298 -1.091972
C 1.494486 3.557017 -1.673494
C 3.976160 0.048882 2.590238
C -0.781790 -2.431131 -2.904005
C -0.885400 3.236666 -1.965391
C 4.914008 -0.547122 1.742559
C -0.612098 -3.717167 -2.384643
C 0.269881 3.994229 -2.184586
C -4.159993 1.605042 1.088423
C -4.168022 -0.708281 0.383015
C -4.836566 0.510068 0.543061
H -0.393407 1.077586 2.289959
H 2.917125 -1.182560 -0.942348
H 0.630398 -2.922998 0.686737
H 2.536075 2.044286 -0.554626
H 1.937840 0.670320 2.855780
H -0.586923 -0.317578 -2.562111
H -1.733604 1.472236 -1.076091
H -2.306417 2.345190 1.897025
H -2.321051 -1.793108 0.637666
H 5.251528 -1.452219 -0.187947
H 0.030865 -4.884733 -0.686197
H 2.395351 4.143516 -1.841883
H 4.275118 0.386438 3.580498
H -1.172673 -2.297764 -3.910453
H -1.840764 3.575282 -2.361059
H 5.944350 -0.672217 2.070419
H -0.872363 -4.587180 -2.984756
H 0.214357 4.921700 -2.751601
H -4.677443 2.553822 1.220270
H -4.692889 -1.565060 -0.037245
H -5.879345 0.603328 0.248497


%chk=000224226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224226

0 1
Br -0.449374 -1.495128 3.008140
Si 0.512665 -0.092658 0.188850
C -0.718484 0.099106 1.692501
C 2.281796 -0.258095 0.887780
C 0.095965 -1.584502 -0.930299
C 0.372264 1.549586 -0.793068
C -2.181950 0.271616 1.386077
C 3.220685 -1.150336 0.302310
C 0.189060 -2.918690 -0.438668
C 1.526160 2.352281 -1.014631
C 2.714055 0.545464 1.979210
C -0.289555 -1.396519 -2.286427
C -0.870422 2.005244 -1.320404
C -2.861295 1.426661 1.858767
C -2.906222 -0.677073 0.612472
C 4.543825 -1.241892 0.793109
C -0.106920 -4.022520 -1.270001
C 1.444368 3.566038 -1.735678
C 4.033499 0.456419 2.475421
C -0.581769 -2.499564 -3.121767
C -0.955349 3.218841 -2.040008
C 4.953486 -0.439632 1.882286
C -0.495024 -3.816232 -2.614697
C 0.202420 4.003637 -2.249707
C -4.223333 1.641271 1.552005
C -4.268366 -0.467337 0.313645
C -4.932066 0.694296 0.777712
H -0.360049 0.943462 2.307893
H 2.918234 -1.781583 -0.541936
H 0.487900 -3.098769 0.600478
H 2.497480 2.027254 -0.623363
H 2.018031 1.246617 2.457680
H -0.353289 -0.382979 -2.699168
H -1.783238 1.417435 -1.167134
H -2.316908 2.161253 2.464481
H -2.402208 -1.583318 0.261805
H 5.250314 -1.938536 0.327408
H -0.032535 -5.039748 -0.868889
H 2.347523 4.166353 -1.894923
H 4.341663 1.080352 3.322106
H -0.874549 -2.329922 -4.164305
H -1.923171 3.549959 -2.433682
H 5.977461 -0.512131 2.266459
H -0.722477 -4.672250 -3.260487
H 0.137096 4.944827 -2.807776
H -4.729992 2.539711 1.921588
H -4.813994 -1.209824 -0.279282
H -5.990720 0.854457 0.544715


