%chk=000236401.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236401

0 1
S -0.780515 0.915227 0.000168
N 1.896621 1.487094 0.000036
N 1.400273 -0.765985 0.000002
N 3.776122 -1.570889 -0.000205
N 5.429974 0.233404 -0.000293
C 3.125484 0.807974 -0.000061
C -1.596224 -0.717365 0.000548
C 0.905101 0.490728 0.000061
C -3.050208 -0.386832 0.000285
C 2.798570 -0.615998 -0.000109
C -3.738186 -0.232088 -1.214322
C -3.738355 -0.230901 1.214645
C 4.481297 1.187063 -0.000150
C -5.101547 0.073062 -1.210743
C -5.101716 0.074250 1.210577
C -5.785097 0.226699 -0.000205
C 5.041845 -1.096417 -0.000261
H -1.277701 -1.311694 0.883200
H -1.277500 -1.312222 -0.881688
H 1.773043 2.483370 0.000094
H -3.211149 -0.349822 -2.160519
H -3.211458 -0.347721 2.161031
H 4.802648 2.233551 -0.000174
H -5.632724 0.190858 -2.154441
H -5.633021 0.192976 2.154085
H -6.847684 0.463718 -0.000396
H 5.860709 -1.835742 -0.000465


%chk=000236401-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236401

0 1
S -0.721933 1.223883 0.000373
N 2.048750 1.577468 -0.000076
N 1.383996 -0.621918 0.000264
N 3.663669 -1.597864 -0.000021
N 5.491114 0.052548 -0.000519
C 3.227315 0.821348 -0.000206
C -1.580569 -0.511227 0.000707
C 0.981633 0.662295 0.000181
C -3.073590 -0.316440 0.000370
C 2.788882 -0.554733 0.000053
C -3.788744 -0.227039 -1.222431
C -3.789211 -0.226268 1.222841
C 4.604838 1.095915 -0.000450
C -5.190483 -0.055668 -1.223749
C -5.190951 -0.054894 1.223517
C -5.895164 0.031080 -0.000278
C 4.977524 -1.222455 -0.000478
H -1.199553 -1.022329 0.896718
H -1.199207 -1.022823 -0.894875
H 1.967986 2.593308 -0.000161
H -3.244349 -0.295430 -2.171903
H -3.245179 -0.294065 2.172564
H 5.026396 2.106999 -0.000600
H -5.731862 0.006796 -2.174079
H -5.732692 0.008169 2.173601
H -6.982995 0.161557 -0.000527
H 5.712981 -2.031913 -0.000136


