%chk=000261589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261589

0 1
Br -5.831631 -1.116719 0.170273
N -0.274569 1.440190 0.029245
N 1.166517 -0.479240 0.026528
N 3.613709 -0.165355 -0.078832
N 2.692083 -2.310106 0.088824
N 4.551464 1.984079 -0.076274
C -1.532834 0.772990 0.069870
C 1.014664 0.882137 -0.002034
C 2.114483 1.770002 -0.059832
C -2.650424 1.568384 0.419862
C -1.712515 -0.584819 -0.252758
C 2.473733 -0.953488 0.006737
C 3.406002 1.196057 -0.086340
C -3.924658 1.004834 0.448269
C -2.990741 -1.141632 -0.219493
C -4.084797 -0.345904 0.129251
C 1.584208 -3.282943 0.100910
H -0.310248 2.461234 0.098806
H 1.983781 2.840219 -0.068295
H -2.527713 2.618732 0.674793
H -0.857549 -1.210822 -0.527935
H -4.784378 1.619770 0.720359
H -3.126727 -2.195548 -0.469280
H 3.642501 -2.661774 0.014226
H 1.172514 -3.438345 -0.912460
H 0.752972 -2.926327 0.742577
H 1.938698 -4.246583 0.499345
H 4.488039 2.950326 -0.344770
H 5.447116 1.539052 -0.221773


%chk=000261589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261589

0 1
Br -5.957918 -1.091155 0.223701
N -0.266320 1.389158 0.077319
N 1.197828 -0.496136 -0.007465
N 3.629690 -0.160320 -0.085842
N 2.701728 -2.295758 -0.091379
N 4.567856 1.972379 -0.079016
C -1.532375 0.759437 0.107952
C 1.028820 0.861012 0.023292
C 2.124501 1.765333 0.002150
C -2.676462 1.607386 0.161410
C -1.723468 -0.650305 0.088763
C 2.497253 -0.935043 -0.060349
C 3.426265 1.194001 -0.053662
C -3.978686 1.071125 0.195348
C -3.027787 -1.187231 0.122790
C -4.143514 -0.328922 0.175745
C 1.619235 -3.278317 -0.070149
H -0.298512 2.410113 0.096770
H 1.977063 2.849080 0.027189
H -2.551675 2.697939 0.176744
H -0.843695 -1.293661 0.047324
H -4.846220 1.735854 0.236328
H -3.165466 -2.272509 0.107843
H 3.676238 -2.590806 -0.130278
H 0.949345 -3.159969 -0.942418
H 1.002553 -3.178106 0.842528
H 2.055807 -4.290759 -0.093581
H 4.524644 2.986433 -0.059897
H 5.466975 1.498150 -0.119360


