%chk=000248718.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248718

0 1
F 9.083792 -0.643799 -0.036606
F -9.082667 -0.643390 0.037760
N 0.645094 -0.240975 0.002025
N -0.643951 -0.240955 -0.003283
C 4.990732 -0.368801 0.007562
C -4.989596 -0.368618 -0.006934
C 1.372969 0.933037 0.004511
C -1.371783 0.933080 -0.006527
C 3.522872 -0.294576 0.007898
C -3.521734 -0.294443 -0.007407
C 2.836028 0.860234 0.009319
C -2.834843 0.860333 -0.011273
C 0.696250 2.174033 0.001156
C -0.695020 2.174055 -0.004017
C 5.765836 0.517609 0.776080
C -5.764669 0.516328 -0.777171
C 5.624598 -1.357896 -0.769154
C -5.623500 -1.356193 0.771686
C 7.159801 0.431855 0.770950
C -7.158637 0.430633 -0.771875
C 7.015775 -1.457346 -0.795642
C -7.014679 -1.455543 0.798362
C 7.752450 -0.555364 -0.020748
C -7.751323 -0.555032 0.021729
H 3.003428 -1.263213 -0.003521
H -3.002323 -1.263068 0.006105
H 3.346221 1.826926 0.003878
H -3.344994 1.827057 -0.007902
H 1.254112 3.109475 0.002194
H -1.252852 3.109515 -0.005685
H 5.276601 1.273251 1.391478
H -5.275410 1.270754 -1.394039
H 5.023780 -2.049879 -1.361579
H -5.022709 -2.047057 1.365439
H 7.762307 1.114588 1.368225
H -7.761120 1.112229 -1.370472
H 7.509539 -2.216866 -1.400416
H -7.508476 -2.213878 1.404596


%chk=000248718-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248718

0 1
F 9.177769 -0.987848 0.036374
F -9.176659 -0.987563 -0.034233
N 0.677536 -0.113475 0.002385
N -0.676391 -0.113453 -0.002472
C 5.003400 -0.330238 0.018553
C -5.002262 -0.330081 -0.018001
C 1.382865 1.088194 0.003795
C -1.381675 1.088238 -0.005957
C 3.545644 -0.166199 0.012768
C -3.544500 -0.166087 -0.012637
C 2.844489 1.013028 0.009418
C -2.843302 1.013117 -0.011384
C 0.699805 2.339527 0.000369
C -0.698567 2.339549 -0.004723
C 5.919894 0.764758 0.021050
C -5.918716 0.764944 -0.022118
C 5.539576 -1.652291 0.022002
C -5.538489 -1.652118 -0.019279
C 7.310575 0.552777 0.026856
C -7.309406 0.553006 -0.027410
C 6.929182 -1.886600 0.027833
C -6.928104 -1.886383 -0.024564
C 7.785901 -0.772985 0.030258
C -7.784782 -0.772741 -0.028646
H 2.944954 -1.085643 0.010758
H -2.943845 -1.085549 -0.009090
H 3.366411 1.979643 0.011099
H -3.365188 1.979747 -0.014737
H 1.269161 3.275256 0.001686
H -1.267887 3.275296 -0.007672
H 5.545339 1.793390 0.018365
H -5.544122 1.793565 -0.021095
H 4.851375 -2.505221 0.019939
H -4.850320 -2.505069 -0.015943
H 8.020165 1.385271 0.028870
H -8.018965 1.385522 -0.030645
H 7.343253 -2.898707 0.030356
H -7.342214 -2.898477 -0.025425


