%chk=000258554.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258554

0 1
S -3.899935 0.786187 -1.618492
S -2.338584 3.361912 -1.323053
O 4.378314 -2.878856 0.184126
O 5.228737 -1.664600 -1.389955
N -2.017179 1.134029 0.128654
N 0.303829 1.964652 0.176997
N 4.384782 -1.889638 -0.535226
C -2.454086 -0.217948 0.302726
C -0.929524 1.765343 0.945913
C -3.504963 -0.562359 -0.580004
C -2.663612 1.826414 -0.880753
C -1.966230 -1.155326 1.222223
C 1.254656 0.954047 -0.019196
C -4.083074 -1.825855 -0.558210
C -2.551242 -2.423227 1.239361
C -3.597112 -2.757635 0.364076
C 1.297618 -0.210056 0.786954
C 2.254286 1.164753 -1.008797
C 2.320186 -1.131415 0.616713
C 3.271490 0.240681 -1.171455
C 3.309798 -0.912121 -0.359358
H -1.294050 2.776570 1.285082
H -0.745778 1.136139 1.851659
H 0.246808 2.704584 -0.535429
H -1.144081 -0.913209 1.895585
H -4.892407 -2.086078 -1.241042
H -2.186163 -3.170849 1.946416
H -4.031912 -3.756552 0.402944
H 0.533075 -0.389605 1.542165
H 2.223428 2.053036 -1.638725
H 2.369220 -2.035895 1.235153
H 4.051705 0.388676 -1.928452


%chk=000258554-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258554

0 1
S -3.789748 0.613787 -1.845772
S -2.097708 3.220919 -1.579535
O 4.539571 -2.924342 -0.150449
O 5.625289 -1.325341 -1.369797
N -2.001279 0.994634 0.062948
N 0.312313 1.888084 0.154654
N 4.614044 -1.740033 -0.673046
C -2.560528 -0.275014 0.361310
C -0.923239 1.667241 0.867973
C -3.553329 -0.666846 -0.579595
C -2.522590 1.668904 -1.038772
C -2.257095 -1.118389 1.454806
C 1.332619 0.958882 -0.049389
C -4.227245 -1.895386 -0.469505
C -2.935555 -2.350853 1.569105
C -3.906819 -2.743326 0.615619
C 1.295977 -0.365126 0.484116
C 2.475057 1.360790 -0.811155
C 2.370843 -1.243786 0.283616
C 3.545447 0.484231 -1.019193
C 3.492763 -0.817662 -0.463132
H -1.326292 2.653548 1.154462
H -0.757572 1.065954 1.773733
H 0.311125 2.728706 -0.431216
H -1.529797 -0.830916 2.220299
H -4.984753 -2.188389 -1.202595
H -2.705687 -3.009651 2.412526
H -4.418635 -3.704901 0.720378
H 0.421232 -0.723311 1.031865
H 2.510999 2.372712 -1.230833
H 2.355189 -2.261267 0.683402
H 4.423405 0.781947 -1.598227


