%chk=000248407.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248407

0 1
S -2.069020 -0.121985 0.002530
O -2.554517 0.638332 -1.118342
O -2.518637 -1.530159 0.086485
O -0.268491 2.166118 0.629845
O 3.712143 -0.002884 -0.090324
N 1.782304 -1.231023 -0.180984
N 1.714535 1.133968 0.256960
N -2.560486 0.615135 1.454078
N -0.189998 -2.541267 -0.296909
C -0.363141 -0.142444 0.068560
C 0.374751 -1.310138 -0.133198
C 0.268510 1.117256 0.334165
C 2.504378 0.009954 -0.009267
H 2.360656 -2.062314 -0.352140
H 2.196774 2.033818 0.407486
H -3.472532 0.395195 1.842406
H -2.336897 1.601168 1.607416
H 0.351185 -3.378510 -0.443291
H -1.243817 -2.657218 -0.199375


%chk=000248407-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248407

0 1
S -2.179164 -0.176400 0.038434
O -2.723043 0.613659 -1.268052
O -2.652458 -1.747446 0.205861
O -0.307518 2.191059 0.695097
O 3.774049 0.028315 -0.089835
N 1.794574 -1.206385 -0.200552
N 1.715071 1.102053 0.271632
N -2.572742 0.649181 1.605842
N -0.146259 -2.558195 -0.333571
C -0.329476 -0.158828 0.115942
C 0.405237 -1.330619 -0.141982
C 0.294094 1.115432 0.379446
C 2.521271 -0.001696 -0.012991
H 2.384969 -2.024210 -0.371952
H 2.194271 1.992392 0.437718
H -3.598448 0.662396 1.729902
H -2.119911 1.585514 1.568695
H 0.413498 -3.377032 -0.563044
H -1.180314 -2.626186 -0.200488


