%chk=000214114.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214114

0 1
Br 1.089573 -1.995978 2.842675
O -0.859264 -0.783435 -0.569736
N -4.455770 -1.197750 -0.109118
C 0.106952 0.096653 -1.183462
C 1.440974 -0.590515 -0.967958
C 0.121000 1.476259 -0.551527
C 1.917831 -0.895958 0.323217
C 0.280844 1.652083 0.835759
C -2.243929 -0.378057 -0.743585
C -2.991482 -1.391528 0.137437
C 2.223162 -0.898538 -2.091751
C -0.015780 2.600024 -1.381047
C 1.113150 -0.593688 1.511587
C 0.403627 0.514865 1.759988
C 3.188305 -1.486782 0.463816
C 0.295479 2.954349 1.372056
C 3.477125 -1.489975 -1.939603
C 0.007682 3.886621 -0.842551
C 3.962042 -1.778192 -0.658468
C 0.164841 4.063056 0.537717
C -5.243380 -1.450940 1.133685
C -4.932339 -2.081958 -1.214426
H -0.145708 0.161582 -2.269591
H -2.382108 0.658921 -0.396308
H -2.507050 -0.457568 -1.810335
H -2.622849 -2.417766 -0.078965
H -2.735128 -1.202337 1.202133
H 1.850398 -0.676635 -3.090968
H -0.139907 2.470204 -2.455773
H -0.151909 0.635996 2.697618
H 3.577966 -1.716372 1.457238
H 0.418737 3.094465 2.445426
H 4.078097 -1.727544 -2.815955
H -0.097346 4.752702 -1.493544
H 4.943898 -2.233732 -0.538043
H 0.184076 5.067254 0.958920
H -4.933470 -0.728445 1.906159
H -5.146808 -2.465589 1.546356
H -6.309084 -1.262278 0.926462
H -4.341878 -1.879001 -2.121826
H -5.979622 -1.828452 -1.444328
H -4.875748 -3.159819 -1.002781


%chk=000214114-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214114

0 1
Br 1.887885 -1.357458 3.365555
O -0.796046 -0.859168 -0.322728
N -4.504205 -1.193204 0.036843
C 0.195086 -0.001068 -1.011225
C 1.548709 -0.661770 -0.832068
C 0.157636 1.445148 -0.530191
C 2.138854 -0.876500 0.457881
C 0.389441 1.776840 0.841667
C -2.189118 -0.429940 -0.534731
C -3.065101 -1.547124 0.051522
C 2.226368 -1.116723 -1.988649
C -0.196547 2.468090 -1.441540
C 1.526331 -0.339524 1.685544
C 0.794309 0.804027 1.863767
C 3.379130 -1.577299 0.521839
C 0.197507 3.127543 1.258047
C 3.461587 -1.789732 -1.908534
C -0.343511 3.807789 -1.023596
C 4.035852 -2.025319 -0.638182
C -0.155726 4.134766 0.340917
C -5.286828 -2.004760 0.991507
C -5.096364 -1.221416 -1.316203
H -0.049066 0.002704 -2.097389
H -2.399082 0.524323 -0.012993
H -2.369721 -0.284950 -1.623271
H -2.852517 -2.502524 -0.490875
H -2.751017 -1.694115 1.100964
H 1.759971 -0.955797 -2.967801
H -0.376998 2.204060 -2.491094
H 0.525916 1.072337 2.892583
H 3.833300 -1.757862 1.500464
H 0.353294 3.382442 2.313184
H 3.960002 -2.140152 -2.818577
H -0.621716 4.583688 -1.744862
H 4.991479 -2.553375 -0.551965
H -0.284523 5.167027 0.683943
H -4.868904 -1.890966 2.007247
H -5.301134 -3.097007 0.743063
H -6.332586 -1.647957 1.010550
H -4.574209 -0.512961 -1.982060
H -6.154749 -0.909805 -1.260949
H -5.057784 -2.236104 -1.791004


