%chk=000213890.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213890

0 1
Br -6.836523 -1.915736 -0.000400
O 3.692160 -2.148073 0.000515
O 5.584527 -0.714233 0.000259
N -1.777222 1.511230 0.000540
N -0.547537 0.936117 0.000280
C 3.280418 -0.821187 0.000423
C 4.418382 0.039643 0.000263
C 1.852544 1.076760 0.000283
C 1.993233 -0.339017 0.000447
C 4.293079 1.410908 0.000129
C 2.974509 1.916655 0.000144
C 5.157614 -2.117170 0.000077
C 0.516472 1.700728 0.000224
C -2.926847 0.671484 0.000210
C -4.188107 1.306880 0.000084
C -2.835589 -0.736037 0.000134
C -5.347694 0.531193 -0.000094
C -4.000324 -1.499497 -0.000045
C -5.245791 -0.861729 -0.000151
H 1.123930 -0.995343 0.000557
H 5.155493 2.071115 -0.000007
H 2.844174 2.998545 0.000006
H 5.503828 -2.574061 -0.936120
H 5.504392 -2.574455 0.935865
H 0.513149 2.799942 0.000293
H -1.911420 2.525962 0.000295
H -4.269819 2.390865 0.000140
H -1.857924 -1.221866 0.000223
H -6.324630 1.018850 -0.000181
H -3.933775 -2.589775 -0.000093


%chk=000213890-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213890

0 1
Br -7.068131 -1.819152 -0.000114
O 3.854911 -2.166236 0.000443
O 5.716131 -0.644698 0.000370
N -1.794332 1.424102 0.000164
N -0.562720 0.820743 0.000214
C 3.395656 -0.825412 0.000324
C 4.494341 0.067900 0.000284
C 1.862709 1.032792 0.000264
C 2.078127 -0.385875 0.000322
C 4.313591 1.452085 0.000243
C 2.974159 1.922510 0.000227
C 5.338961 -2.085401 0.000108
C 0.510329 1.591582 0.000244
C -2.978236 0.664961 0.000094
C -4.228446 1.341222 0.000056
C -2.948960 -0.755850 0.000065
C -5.434398 0.611511 -0.000007
C -4.155102 -1.484783 0.000004
C -5.387605 -0.798031 -0.000032
H 1.228268 -1.071610 0.000365
H 5.163583 2.138691 0.000225
H 2.794466 3.003849 0.000182
H 5.726227 -2.556575 -0.919769
H 5.726660 -2.557021 0.919562
H 0.431116 2.698041 0.000212
H -1.872151 2.451692 0.000139
H -4.265349 2.437868 0.000076
H -1.984902 -1.268995 0.000089
H -6.393406 1.137340 -0.000037
H -4.130796 -2.578552 -0.000018


