%chk=000298680.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298680

0 1
S 1.620660 1.476127 -0.001225
N -0.717573 -0.008350 -0.000945
N 1.434918 -1.126395 0.000562
C 0.674794 -0.036570 -0.000270
C -1.562098 -1.152732 -0.001192
C -1.534003 1.156078 0.000737
C -2.867312 -0.703925 -0.000010
C -2.849600 0.735803 0.001060
C 3.089994 0.548045 0.000250
C 2.802736 -0.785969 0.000600
H -1.152749 -2.149949 -0.002362
H -1.125830 2.149635 0.001046
H -3.754725 -1.306714 -0.000068
H -3.722879 1.359390 0.002008
H 4.055134 1.024221 0.000258
H 3.514432 -1.609194 0.001251


%chk=000298680-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298680

0 1
S 1.645768 1.563054 0.000335
N -0.728221 0.022493 0.000262
N 1.395282 -1.107616 0.001265
C 0.669695 -0.001021 0.000537
C -1.536395 -1.136564 -0.000748
C -1.558604 1.164076 0.000987
C -2.864543 -0.723294 -0.000691
C -2.879499 0.726538 0.000572
C 3.115688 0.518932 -0.000836
C 2.766212 -0.818766 0.000687
H -1.071440 -2.118392 -0.001390
H -1.139404 2.168327 0.001876
H -3.731246 -1.382572 -0.001371
H -3.758012 1.369955 0.001043
H 4.104757 0.970646 -0.001720
H 3.475860 -1.646295 0.000890


