%chk=000183199.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183199

0 1
Br 4.710384 2.585643 -0.000650
Cl -2.787078 -3.030778 -0.000378
C 0.144272 -0.269058 0.000160
C 1.590113 -0.251029 0.000152
C -0.575802 0.936248 0.000265
C -0.553031 -1.537094 0.000020
C -2.018565 0.917499 0.000136
C 2.286667 0.989077 0.000152
C 2.322862 -1.478738 0.000135
C -2.706078 -0.325691 -0.000124
C -1.932864 -1.530794 -0.000154
C 0.156850 2.179038 0.000501
C 0.236528 -2.763593 0.000065
C 1.516751 2.208835 0.000439
C 1.586018 -2.735609 0.000092
C 3.702119 0.958881 -0.000070
C 3.716346 -1.456009 0.000132
C -2.784240 2.124377 0.000298
C -4.135851 -0.332361 -0.000319
C 4.408704 -0.233346 0.000006
C -4.157478 2.092287 0.000157
C -4.842073 0.846592 -0.000173
H -0.416223 3.110284 0.000752
H -0.295560 -3.717662 0.000089
H 2.044509 3.165257 0.000661
H 2.171048 -3.656428 0.000076
H 4.282772 -2.387220 0.000197
H -2.255204 3.079794 0.000527
H -4.673094 -1.282060 -0.000591
H 5.501198 -0.239739 -0.000037
H -4.737537 3.014581 0.000283
H -5.931661 0.842511 -0.000300


%chk=000183199-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183199

0 1
Br 4.796179 2.622814 0.000453
Cl -2.845742 -3.127784 -0.000168
C 0.156844 -0.263544 0.000054
C 1.600514 -0.255399 0.000094
C -0.578181 0.967517 0.000119
C -0.544902 -1.542707 -0.000047
C -2.031251 0.945118 0.000088
C 2.316029 1.003921 0.000206
C 2.335231 -1.497154 0.000022
C -2.731826 -0.326765 0.000005
C -1.952355 -1.526308 -0.000062
C 0.167422 2.198975 0.000215
C 0.227110 -2.769259 -0.000122
C 1.552643 2.221889 0.000256
C 1.604816 -2.745377 -0.000088
C 3.743876 0.958765 0.000255
C 3.750880 -1.471678 0.000056
C -2.820511 2.140868 0.000138
C -4.166927 -0.341337 -0.000014
C 4.458004 -0.249824 0.000174
C -4.216977 2.101242 0.000112
C -4.897182 0.846367 0.000038
H -0.362715 3.154259 0.000258
H -0.310754 -3.720436 -0.000212
H 2.085190 3.177070 0.000320
H 2.173569 -3.682198 -0.000142
H 4.307074 -2.415578 -0.000008
H -2.327331 3.116307 0.000195
H -4.682235 -1.305314 -0.000070
H 5.551185 -0.242146 0.000200
H -4.790977 3.034012 0.000152
H -5.991896 0.817377 0.000019


