%chk=000255303.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255303

0 1
S -0.825355 -1.254914 0.687918
S 1.763617 -2.571425 1.402247
O 0.888603 1.865417 -0.754369
N 1.480413 -0.173447 0.200713
N -4.145919 0.603445 -1.324419
C 2.917398 0.051649 0.096199
C 0.532495 0.818658 -0.281451
C -0.854414 0.324421 -0.074360
C 0.961181 -1.333223 0.762869
C 3.485434 1.138108 0.777542
C 3.695286 -0.811088 -0.690124
C -1.952074 0.990441 -0.441583
C -3.331911 0.507989 -0.230156
C 4.861350 1.355676 0.666558
C 5.069799 -0.577983 -0.782232
C 5.652434 0.500507 -0.107651
C -3.781455 0.015390 1.007336
C -5.111210 -0.410593 1.111495
C -5.947476 -0.336515 -0.002759
C -5.425628 0.178999 -1.204813
H 2.866140 1.806183 1.374234
H 3.241452 -1.651188 -1.215084
H -1.872800 1.962814 -0.960526
H 5.316991 2.197186 1.187877
H 5.688904 -1.242284 -1.384848
H 6.724496 0.674932 -0.186349
H -3.118021 -0.026465 1.870877
H -5.486212 -0.799036 2.059603
H -6.982816 -0.666507 0.050359
H -6.045400 0.261754 -2.106904


%chk=000255303-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255303

0 1
S -0.695051 -1.328822 1.280138
S 2.082051 -2.272894 2.227611
O 0.814674 1.483325 -1.043787
N 1.565457 -0.239214 0.408226
N -4.178763 1.209104 -0.952013
C 2.969805 0.056084 0.173172
C 0.550054 0.538826 -0.261907
C -0.810964 0.057123 0.105776
C 1.150973 -1.251491 1.277007
C 3.472495 1.328649 0.519322
C 3.800153 -0.921393 -0.416985
C -1.928326 0.647156 -0.426290
C -3.350155 0.363006 -0.233592
C 4.831064 1.623462 0.272695
C 5.157982 -0.619072 -0.655116
C 5.675501 0.651416 -0.311022
C -3.880199 -0.667404 0.597888
C -5.278168 -0.828526 0.689467
C -6.122025 0.035655 -0.043845
C -5.521280 1.036415 -0.847625
H 2.810823 2.076814 0.965690
H 3.390708 -1.900911 -0.680874
H -1.734592 1.479604 -1.117135
H 5.226701 2.609831 0.536327
H 5.808222 -1.373464 -1.110246
H 6.729571 0.882658 -0.498976
H -3.222533 -1.333111 1.163190
H -5.700451 -1.615199 1.323049
H -7.211397 -0.057378 0.001318
H -6.137026 1.728652 -1.433263


