%chk=000245125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245125

0 1
Br -2.545948 3.223098 0.004838
O 1.100481 -2.821898 -0.003547
O -3.721769 -1.919083 -0.002518
N -3.445266 0.375616 0.001032
C 0.762008 0.721809 0.001305
C 0.151456 -0.573270 -0.000438
C 2.227942 0.553491 0.001015
C 2.522777 -0.845980 -0.000912
C 1.240897 -1.629013 -0.001958
C -1.210759 -0.741395 -0.000593
C -0.019944 1.861091 0.002900
C -2.027850 0.428027 0.001035
C 3.248346 1.486742 0.002254
C -1.415243 1.692565 0.002726
C 3.826286 -1.299808 -0.001580
C 4.580140 1.017232 0.001550
C 4.866143 -0.344500 -0.000324
C -4.223547 -0.816532 -0.000856
C -5.702384 -0.558839 -0.000554
H -1.663577 -1.744695 -0.001928
H 0.421416 2.857893 0.004250
H 3.042631 2.553942 0.003739
H 4.049037 -2.367674 -0.003039
H 5.394585 1.742907 0.002504
H 5.900633 -0.685367 -0.000842
H -3.952717 1.270030 0.002476
H -6.036508 -0.007521 0.889305
H -6.247580 -1.519486 -0.002139
H -6.036384 -0.004680 -0.888701


%chk=000245125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245125

0 1
Br -2.560181 3.303231 0.004895
O 1.127221 -2.867613 -0.003684
O -3.822302 -2.022244 -0.002619
N -3.471981 0.303996 0.000771
C 0.774704 0.720239 0.001229
C 0.172208 -0.571361 -0.000561
C 2.251417 0.562569 0.000998
C 2.551264 -0.833543 -0.000941
C 1.264061 -1.614345 -0.002107
C -1.212847 -0.758269 -0.000771
C -0.040295 1.863581 0.002853
C -2.062525 0.392671 0.000855
C 3.291972 1.507577 0.002327
C -1.440081 1.679081 0.002630
C 3.873478 -1.302445 -0.001558
C 4.632611 1.037023 0.001701
C 4.924536 -0.349144 -0.000211
C -4.280252 -0.845774 -0.000918
C -5.774885 -0.531422 -0.000335
H -1.661018 -1.754309 -0.002170
H 0.376670 2.874345 0.004268
H 3.088238 2.583998 0.003827
H 4.077193 -2.378272 -0.003067
H 5.456105 1.759871 0.002723
H 5.967357 -0.683374 -0.000653
H -3.964027 1.203764 0.002110
H -6.060227 0.050242 0.895772
H -6.332759 -1.478339 -0.001736
H -6.060356 0.052970 -0.894625


