%chk=000225408.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225408

0 1
S -2.838722 2.653324 0.317279
O 1.011009 -3.380073 -0.617828
N -0.628928 1.191564 0.232412
N -2.644588 -0.088823 0.063728
N 2.007159 1.991987 0.406709
C 0.364845 0.202699 0.064695
C 1.751797 0.650946 0.151240
C 2.801386 -0.296062 -0.028342
C -4.115691 -0.241431 -0.032006
C 0.099997 -1.132127 -0.187914
C 2.506620 -1.653359 -0.289317
C 1.174979 -2.040032 -0.362004
C 4.152052 0.188269 0.067201
C -2.024649 1.023914 0.169381
C -4.374926 -1.540938 -0.807420
C -4.718122 -0.301020 1.378133
C 4.386612 1.512095 0.321130
C 3.267871 2.397527 0.487340
C -0.337704 -3.905073 -0.698353
C -2.389326 3.458065 -1.236408
H -4.580596 0.614696 -0.594448
H -0.929905 -1.492234 -0.245345
H 3.299852 -2.380844 -0.427893
H -0.285860 2.135196 0.491995
H 4.968620 -0.521052 -0.066030
H -5.448126 -1.719539 -0.925601
H -3.923792 -1.505587 -1.805873
H -3.944338 -2.407473 -0.290944
H -5.787925 -0.530947 1.339556
H -4.602801 0.651641 1.908326
H -4.235428 -1.073529 1.990071
H 5.394713 1.912175 0.401042
H 3.440496 3.460084 0.691421
H -0.150975 -4.968356 -0.894866
H -0.877262 -3.437627 -1.527423
H -0.857385 -3.763925 0.254391
H -2.878444 4.442178 -1.257461
H -2.731395 2.885448 -2.106378
H -1.307018 3.613045 -1.325094


%chk=000225408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225408

0 1
S -2.968525 2.665059 0.163552
O 1.031924 -3.503101 -0.470524
N -0.691339 1.116893 0.152535
N -2.686384 -0.162637 0.067778
N 1.812322 2.010613 0.223971
C 0.300807 0.134999 0.009844
C 1.654712 0.647830 0.048681
C 2.761694 -0.269254 -0.090192
C -4.156116 -0.302120 -0.030353
C 0.071428 -1.237953 -0.153988
C 2.511659 -1.659793 -0.266782
C 1.186777 -2.121406 -0.296776
C 4.076690 0.306609 -0.037642
C -2.074030 0.977139 0.107360
C -4.472151 -1.511877 -0.934126
C -4.751042 -0.483537 1.387128
C 4.227745 1.683342 0.140763
C 3.063849 2.506625 0.268602
C -0.330551 -4.046738 -0.506131
C -1.897984 3.697596 -1.012755
H -4.599260 0.614882 -0.479905
H -0.962805 -1.586294 -0.157320
H 3.333063 -2.373619 -0.375170
H -0.277049 2.047718 0.309382
H 4.951792 -0.345341 -0.137087
H -5.564557 -1.644449 -1.036161
H -4.040815 -1.374386 -1.941102
H -4.046638 -2.434922 -0.499448
H -5.844706 -0.631551 1.328748
H -4.552486 0.401714 2.016744
H -4.303333 -1.364736 1.880897
H 5.220013 2.142458 0.185316
H 3.159013 3.588921 0.410794
H -0.199117 -5.128325 -0.656370
H -0.912707 -3.619554 -1.344134
H -0.862141 -3.862243 0.446141
H -2.495676 4.594969 -1.235455
H -1.709516 3.134684 -1.937903
H -0.950458 3.996588 -0.539809


