%chk=000248695.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248695

0 1
S 0.702105 -0.090608 0.066043
F -3.096373 -3.160388 -1.703872
N -3.380303 1.611256 1.017822
N -2.352056 2.244761 1.384128
C -2.003797 -0.165657 0.010353
C -0.858575 0.586870 0.445161
C 1.926208 1.080012 0.740085
C -3.279268 0.389756 0.321250
C 3.234770 0.449977 0.387201
C -1.944616 -1.401146 -0.694384
C -4.484160 -0.276093 -0.064461
C -3.132412 -2.002927 -1.043493
C -1.057720 1.769707 1.119127
C 3.857095 0.754406 -0.834259
C 3.846507 -0.449274 1.275468
C -4.417040 -1.466930 -0.743744
C 5.082284 0.166547 -1.158900
C 5.071744 -1.033166 0.943871
C 5.691823 -0.726373 -0.271629
H 1.799975 1.201345 1.833775
H 1.807714 2.083774 0.287026
H -0.983874 -1.854877 -0.948659
H -5.440472 0.187228 0.195414
H -0.260149 2.415475 1.491264
H 3.385709 1.444641 -1.532516
H 3.366881 -0.697112 2.221369
H -5.317412 -2.000275 -1.052430
H 5.562606 0.404420 -2.107223
H 5.543834 -1.730542 1.634817
H 6.646572 -1.182707 -0.527206


%chk=000248695-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248695

0 1
S 0.680214 -0.277396 -0.155599
F -3.489938 -3.249773 -1.685830
N -3.422744 1.640756 1.040281
N -2.267685 2.259122 1.352927
C -2.127938 -0.223229 -0.039008
C -0.913004 0.468907 0.311993
C 1.949408 0.952332 0.601211
C -3.364278 0.418911 0.355319
C 3.340175 0.426067 0.343751
C -2.180298 -1.471781 -0.732949
C -4.618767 -0.199488 0.045490
C -3.426662 -2.022230 -1.004806
C -1.048745 1.687132 0.996576
C 4.067449 0.840148 -0.801891
C 3.938237 -0.493453 1.244200
C -4.659977 -1.416315 -0.632668
C 5.370353 0.349198 -1.040117
C 5.240197 -0.985611 1.006930
C 5.959757 -0.565095 -0.136200
H 1.722979 1.016549 1.678013
H 1.779692 1.928370 0.118900
H -1.270270 -1.992159 -1.046153
H -5.528525 0.319144 0.361033
H -0.192268 2.289621 1.305080
H 3.612549 1.547591 -1.505761
H 3.381532 -0.823477 2.129537
H -5.601339 -1.912951 -0.883342
H 5.923925 0.679277 -1.925926
H 5.692938 -1.692713 1.710557
H 6.970633 -0.945353 -0.320148


