%chk=000220169.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220169

0 1
S 1.181970 2.922265 0.000242
N -1.299624 2.539008 0.000353
N -0.495388 3.486923 0.000435
C 0.651780 1.262469 0.000111
C -0.720537 1.226258 0.000203
C 1.627697 0.181923 -0.000067
C -1.604546 0.053396 0.000148
C 2.098056 -0.337261 -1.217511
C 2.097050 -0.338554 1.217212
C -2.024315 -0.503772 1.217511
C -2.023121 -0.504554 -1.217267
C 3.037707 -1.371075 -1.211873
C 3.036710 -1.372358 1.211252
C -2.858010 -1.625267 1.211883
C -2.856824 -1.626045 -1.211734
C 3.508131 -1.888404 -0.000390
C -3.273125 -2.187272 0.000051
H 1.728718 0.062890 -2.160927
H 1.726925 0.060597 2.160743
H -1.705980 -0.059969 2.159350
H -1.703847 -0.061372 -2.159079
H 3.403226 -1.775518 -2.155110
H 3.401454 -1.777800 2.154361
H -3.186824 -2.060182 2.154566
H -3.184714 -2.061566 -2.154460
H 4.240444 -2.694471 -0.000515
H -3.923213 -3.060588 0.000013


%chk=000220169-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220169

0 1
S 1.237786 2.994375 -0.257394
N -1.305753 2.477432 0.369536
N -0.645910 3.552881 0.224623
C 0.663096 1.313565 -0.141276
C -0.709721 1.216264 0.182906
C 1.634347 0.205336 -0.294583
C -1.581374 0.021820 0.286476
C 2.593662 0.222439 -1.344621
C 1.657842 -0.868214 0.640015
C -2.677286 0.041377 1.192644
C -1.386725 -1.124928 -0.529900
C 3.541703 -0.814866 -1.467617
C 2.612256 -1.898937 0.517787
C -3.542718 -1.067330 1.295912
C -2.252484 -2.233311 -0.421325
C 3.555422 -1.879640 -0.536960
C -3.330827 -2.213261 0.494034
H 2.584622 1.046262 -2.067174
H 0.936012 -0.883680 1.462533
H -2.846052 0.934296 1.803410
H -0.570399 -1.146183 -1.258169
H 4.269672 -0.790416 -2.285623
H 2.623524 -2.713997 1.249532
H -4.381913 -1.036053 1.999379
H -2.091667 -3.108675 -1.060175
H 4.295536 -2.682088 -0.628221
H -4.002849 -3.074767 0.573752


