%chk=000066521.chk %nprocshared=4 %mem=3GB #p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm 000066521 0 1 Br -1.177800 3.286100 -4.6000001E-03 Br -1.113000 -3.308200 -3.5999999E-03 C 0.2222000 0.7098000 1.0000000E-03 C 0.2359000 -0.7053000 6.0000003E-04 C -1.009500 1.384800 1.7000000E-03 C -0.9823000 -1.404000 8.9999998E-04 C 1.440500 1.408400 7.9999998E-04 C 1.467500 -1.380300 -9.9999997E-05 C -2.210200 0.6744000 1.9000000E-03 C -2.196700 -0.7172000 1.5000000E-03 C 2.654900 0.7216000 9.9999997E-05 C 2.668400 -0.6701000 -3.0000001E-04 H 1.491300 2.493200 1.4000000E-03 H 1.539400 -2.463800 -3.0000001E-04 H -3.169200 1.186800 1.5000000E-03 H -3.145600 -1.248200 1.0000000E-03 H 3.590500 1.273300 -9.9999997E-05 H 3.614500 -1.203500 -7.9999998E-04 %chk=000066521-Freq.chk %nprocshared=4 %mem=7GB #p freq=noraman PBEPBE/SDD 000066521 0 1 Br -1.154280 3.360086 0.000113 Br -1.088577 -3.381878 -0.000547 C 0.224633 0.732581 -0.000116 C 0.238765 -0.728108 -0.000256 C -1.049962 1.398440 0.000046 C -1.022640 -1.418587 -0.000124 C 1.476704 1.430639 0.000105 C 1.504189 -1.401711 -0.000281 C -2.251719 0.691468 0.000669 C -2.237938 -0.735171 0.000599 C 2.690946 0.740661 0.000075 C 2.704777 -0.688224 -0.000158 H 1.469577 2.524950 0.000318 H 1.518479 -2.495980 -0.000346 H -3.209256 1.219700 0.001275 H -3.185097 -1.281841 0.001106 H 3.633880 1.298188 0.000278 H 3.658320 -1.227414 -0.000156