%chk=000253147.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253147

0 1
S 3.817407 -1.670843 0.021479
N 2.608498 0.653870 0.004258
N 1.117446 -1.313104 0.009495
N -0.042068 -0.584676 0.003421
C -2.436113 -0.438301 -0.003797
C 4.011729 0.884069 0.007866
C 2.333239 -0.637991 0.010492
C -3.660324 -1.132382 -0.002282
C -2.434778 0.966988 -0.011785
C 4.797098 -0.234919 0.016766
C 4.465759 2.294562 0.001597
C -1.183949 -1.220805 0.003092
C -4.863807 -0.424868 -0.008682
C -3.643966 1.666459 -0.018153
C -4.858769 0.974334 -0.016625
H -3.675405 -2.220288 0.003879
H -1.485230 1.509779 -0.012977
H 5.869415 -0.293538 0.020653
H 5.559054 2.385938 0.005170
H 4.080967 2.828032 -0.884416
H 4.074387 2.837982 0.878646
H -1.314423 -2.313151 0.007618
H -5.809370 -0.964581 -0.007483
H -3.637245 2.755691 -0.024326
H 1.126555 -2.339666 0.015297
H -5.799006 1.522407 -0.021601


%chk=000253147-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253147

0 1
S 3.861496 -1.778763 0.022018
N 2.656308 0.631390 0.004892
N 1.123952 -1.252518 0.010729
N -0.024331 -0.490786 0.003743
C -2.450665 -0.408510 -0.003553
C 4.048148 0.867229 0.007761
C 2.377697 -0.655423 0.011241
C -3.669632 -1.142644 -0.003085
C -2.500986 1.016325 -0.011026
C 4.846810 -0.263583 0.016456
C 4.535041 2.291851 0.001187
C -1.177081 -1.134668 0.003606
C -4.911297 -0.472268 -0.009877
C -3.742083 1.679956 -0.017796
C -4.952876 0.941325 -0.017272
H -3.640823 -2.240086 0.002601
H -1.558322 1.573002 -0.011337
H 5.932527 -0.327522 0.019987
H 5.636446 2.339589 0.004546
H 4.159812 2.821516 -0.892940
H 4.153935 2.831732 0.886672
H -1.232661 -2.243914 0.008867
H -5.843126 -1.048747 -0.009437
H -3.772188 2.775424 -0.023520
H 1.077228 -2.282339 0.015732
H -5.916228 1.463429 -0.022593


