%chk=000234542.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234542

0 1
S -1.786989 0.889231 -0.126069
N -4.421080 0.669386 -0.079523
N -3.146957 -1.402821 -0.266841
C 0.880733 0.293672 -0.608021
C 1.991997 -0.558638 0.149613
C 1.481792 -0.089223 1.563596
C -0.408255 -0.287493 0.054061
C 1.141119 1.720647 -0.033144
C -0.020223 -0.490077 1.534632
C 1.532602 1.458820 1.445087
C 0.885070 0.221778 -2.117509
C 1.900209 -2.070490 -0.072912
C 3.430886 -0.139229 -0.161517
C -3.258341 -0.124174 -0.193070
H 2.034372 -0.492620 2.417048
H -0.702442 -1.251115 -0.425832
H 0.277310 2.393188 -0.123572
H 1.956225 2.216320 -0.584137
H -0.171086 -1.536029 1.847920
H -0.617745 0.119759 2.231001
H 2.534706 1.847636 1.677606
H 0.837094 1.944842 2.145323
H 1.842246 0.558223 -2.532253
H 0.716461 -0.801549 -2.474571
H 0.097591 0.850302 -2.553077
H 2.159884 -2.331406 -1.105009
H 0.902818 -2.481437 0.115793
H 2.592179 -2.604532 0.587705
H 3.710578 -0.424636 -1.181745
H 4.134521 -0.624936 0.523542
H 3.594414 0.939490 -0.076589
H -5.274871 0.308116 -0.480599
H -4.337177 1.672019 -0.182418
H -3.966641 -1.999826 -0.292615


%chk=000234542-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234542

0 1
S -1.938168 0.983331 0.317605
N -4.398000 0.478397 -0.625877
N -2.843311 -1.389358 -0.760599
C 0.795609 0.332827 -0.453512
C 1.946966 -0.565141 0.188606
C 1.668477 -0.037182 1.644624
C -0.422414 -0.161040 0.392194
C 1.189023 1.759377 0.056448
C 0.151456 -0.342883 1.837393
C 1.802483 1.505957 1.480921
C 0.579402 0.239331 -1.964800
C 1.746521 -2.092905 0.025703
C 3.362751 -0.235889 -0.344253
C -3.175421 -0.165937 -0.458423
H 2.314188 -0.465225 2.431069
H -0.845756 -1.095577 -0.021847
H 0.308148 2.425712 0.082512
H 1.920360 2.226355 -0.628501
H -0.032975 -1.370127 2.199206
H -0.309849 0.347364 2.564420
H 2.857651 1.829421 1.532214
H 1.256633 2.044059 2.276763
H 1.484687 0.551443 -2.518904
H 0.314332 -0.788452 -2.274440
H -0.251688 0.900238 -2.274739
H 1.796714 -2.379094 -1.041951
H 0.786949 -2.461255 0.423384
H 2.555221 -2.636033 0.551018
H 3.473023 -0.585823 -1.388286
H 4.126707 -0.759938 0.261771
H 3.601910 0.839881 -0.325631
H -5.190963 -0.018898 -1.025874
H -4.521395 1.450295 -0.346727
H -3.586272 -1.970035 -1.189584


