%chk=000189256.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189256

0 1
Br 2.311647 2.996554 0.913714
N -0.940587 -1.605301 0.439500
N 0.158352 -1.693238 -0.454751
C -1.860041 -0.526981 0.117976
C 1.324378 -0.876376 -0.300041
C -0.545201 -1.700492 1.882291
C -2.754106 -0.049641 1.095828
C -1.963137 -0.054183 -1.207204
C 1.249092 0.437612 0.203902
C 2.556152 -1.378895 -0.778139
C -3.736401 0.879773 0.743996
C -2.946226 0.876724 -1.538127
C 2.406814 1.210961 0.217117
C 3.689245 -0.568553 -0.757970
C -3.836641 1.349448 -0.567227
C 3.630867 0.736699 -0.252695
H 0.361735 -2.694199 -0.612350
H 0.182556 -2.515314 2.020972
H -1.441985 -1.968634 2.467945
H -0.113514 -0.777797 2.300627
H -2.705266 -0.401623 2.123066
H -1.279204 -0.417451 -1.975477
H 0.299575 0.849132 0.548958
H 2.622349 -2.389394 -1.174635
H -4.427737 1.240876 1.504793
H -3.020060 1.238589 -2.563464
H 4.637047 -0.955062 -1.135463
H -4.600055 2.076040 -0.833095
H 4.523251 1.359727 -0.233947


%chk=000189256-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189256

0 1
Br 3.455427 2.711316 1.350373
N -0.733977 -0.888874 0.805976
N 0.242647 -1.339922 -0.085749
C -1.901309 -0.282670 0.265856
C 1.495653 -0.717008 -0.206377
C -0.738958 -1.503931 2.146790
C -3.086383 -0.159406 1.047185
C -1.897674 0.227509 -1.064863
C 1.789704 0.477705 0.508297
C 2.484844 -1.292384 -1.054507
C -4.229381 0.468460 0.506172
C -3.048952 0.847020 -1.589628
C 3.060228 1.057772 0.354007
C 3.743566 -0.675156 -1.183780
C -4.225001 0.975560 -0.812333
C 4.058236 0.512520 -0.478742
H 0.050120 -2.190960 -0.623923
H 0.289876 -1.814595 2.385355
H -1.407299 -2.389444 2.212291
H -1.058272 -0.767103 2.905390
H -3.125758 -0.552240 2.067210
H -0.989442 0.146349 -1.668932
H 1.025719 0.926377 1.147473
H 2.264457 -2.214619 -1.605658
H -5.131438 0.554574 1.123065
H -3.024120 1.237984 -2.613347
H 4.498947 -1.122249 -1.839298
H -5.115878 1.459155 -1.226030
H 5.037315 0.987258 -0.576173


