%chk=000270917.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270917

0 1
S -4.354913 0.584299 -0.562605
S -3.540193 -1.091748 0.301322
O -3.542679 -0.523800 1.871914
O -4.446614 -2.184030 0.258124
O -2.159216 -1.198427 -0.068781
N -0.105164 0.988699 0.271098
N 2.009055 2.020847 0.336772
N 4.062763 0.729325 0.216845
C -0.772365 2.310797 0.380693
C -2.295961 2.141476 0.467342
C -2.892035 1.642582 -0.840398
C 1.264358 0.877751 0.242211
C 1.894151 -0.429985 0.113121
C 3.318660 -0.445398 0.110651
C 1.187877 -1.657284 -0.013183
C 4.011406 -1.690755 -0.006488
C 1.873955 -2.844607 -0.127179
C 3.296974 -2.858413 -0.121383
C 3.384320 1.879685 0.318720
H -0.389483 2.844235 1.285813
H -0.479686 2.946522 -0.488638
H -2.543788 1.478112 1.329275
H -2.748077 3.117286 0.748429
H -0.690355 0.146517 0.215782
H -3.248101 2.484571 -1.472024
H -2.149966 1.091808 -1.458945
H 0.092044 -1.649990 -0.023887
H 5.102073 -1.675454 -0.002322
H 1.339236 -3.787052 -0.225564
H 3.811687 -3.815581 -0.211826
H 3.956240 2.818642 0.398838
H -3.756104 -1.146729 2.588172


%chk=000270917-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270917

0 1
S -4.494535 0.962986 -0.720286
S -3.594929 -1.190786 0.235729
O -3.941101 -0.844580 2.038870
O -4.336430 -2.572364 -0.154178
O -1.964161 -1.141997 0.069105
N -0.082972 1.086439 0.392248
N 2.029138 2.062998 0.217527
N 4.076543 0.748053 0.004069
C -0.712563 2.418117 0.488777
C -2.246896 2.265482 0.511298
C -2.774930 1.697011 -0.819978
C 1.267863 0.925156 0.248892
C 1.874467 -0.401093 0.130236
C 3.315988 -0.422045 0.016620
C 1.153513 -1.630411 0.125638
C 3.992860 -1.677158 -0.081152
C 1.841403 -2.848404 0.014854
C 3.265225 -2.871900 -0.080186
C 3.385702 1.904148 0.081362
H -0.356921 2.930054 1.403200
H -0.378436 3.043267 -0.361130
H -2.539362 1.603248 1.348675
H -2.705937 3.249391 0.713894
H -0.702165 0.262086 0.430477
H -2.845525 2.466700 -1.614210
H -2.109282 0.902998 -1.214000
H 0.058009 -1.646772 0.197768
H 5.083688 -1.659428 -0.162838
H 1.279500 -3.788262 -0.000509
H 3.787164 -3.831608 -0.159995
H 3.967429 2.831115 0.045215
H -4.102247 -1.728537 2.485907


