%chk=000142105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000142105

0 1
Br -0.454075 -3.060596 0.324041
O 0.444211 -0.276137 0.125570
O -3.965279 1.845415 -0.032302
C -0.920970 -0.234693 0.120792
C -2.937153 -1.606627 0.216647
C 1.182897 0.984433 0.036028
C -1.532521 -1.503014 0.210992
C 2.636316 0.595401 0.065715
C -1.680034 0.942364 0.035334
C -3.074453 0.806644 0.043315
C -3.710792 -0.444853 0.132309
C -3.600521 -2.937227 0.311246
C 3.031386 -0.744770 0.162074
C 3.601867 1.611794 -0.005801
C 4.391317 -1.067537 0.186880
C 4.958628 1.280738 0.019580
C 5.355502 -0.057744 0.115846
C -3.445568 3.194853 -0.128664
H 0.906347 1.610420 0.904652
H 0.908593 1.479965 -0.913729
H -1.210708 1.911685 -0.033688
H -4.796575 -0.488626 0.134088
H -3.309830 -3.464315 1.235093
H -4.696237 -2.872098 0.305435
H -3.307960 -3.590508 -0.527472
H 2.271669 -1.531321 0.217395
H 3.301223 2.654109 -0.080768
H 4.697476 -2.110032 0.261849
H 5.709205 2.067343 -0.035765
H 6.413505 -0.311528 0.135334
H -2.864142 3.441498 0.764132
H -4.369859 3.786544 -0.172546
H -2.861564 3.311321 -1.045912


%chk=000142105-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142105

0 1
Br -0.571365 -3.227470 0.329825
O 0.433249 -0.394773 0.130346
O -3.954832 1.914526 -0.036273
C -0.962004 -0.348764 0.126406
C -3.056066 -1.659435 0.221291
C 1.173116 0.869590 0.042520
C -1.639607 -1.590746 0.215275
C 2.662177 0.566503 0.067343
C -1.705368 0.856211 0.039707
C -3.118562 0.791562 0.044474
C -3.784076 -0.451289 0.134628
C -3.793359 -2.979779 0.317227
C 3.157324 -0.754909 0.160373
C 3.575233 1.649197 -0.005671
C 4.552317 -0.988122 0.179767
C 4.967005 1.414215 0.013827
C 5.460979 0.091499 0.106878
C -3.323557 3.231903 -0.132636
H 0.894856 1.520467 0.898642
H 0.899146 1.392902 -0.898262
H -1.188077 1.815101 -0.029441
H -4.877672 -0.462023 0.136136
H -3.528590 -3.520010 1.244974
H -4.884276 -2.820543 0.306579
H -3.529799 -3.647878 -0.523457
H 2.448482 -1.585530 0.216391
H 3.201101 2.679212 -0.077906
H 4.926901 -2.015423 0.251952
H 5.663331 2.258482 -0.043237
H 6.540989 -0.093077 0.122083
H -2.703072 3.448165 0.759378
H -4.158437 3.945889 -0.183229
H -2.705584 3.317247 -1.048208


