%chk=000202108.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202108

0 1
S 3.662352 -1.849902 0.440729
O -4.962352 0.106486 0.988701
O -4.778410 0.736349 -1.073335
N 2.251226 0.226514 -0.220041
N 4.484075 0.828520 -0.040199
N -4.317757 0.315792 -0.025215
C 2.187670 1.712120 -0.319746
C 1.314256 -0.754541 0.159256
C 3.709986 2.087369 -0.301029
C 3.631306 -0.142854 0.031121
C -0.132038 -0.470216 0.106503
C 1.902299 -1.935601 0.486619
C -0.918552 -0.687334 1.250045
C -0.716605 -0.000675 -1.081556
C -2.288932 -0.431545 1.210727
C -2.086326 0.254994 -1.129248
C -2.862086 0.040318 0.020255
H 1.629592 2.165636 0.520506
H 1.697434 2.004088 -1.268254
H 4.038343 2.517851 -1.268027
H 3.951019 2.819866 0.494317
H 1.422420 -2.865236 0.735759
H -0.456775 -1.055272 2.169055
H -0.099171 0.151058 -1.969919
H -2.918932 -0.594117 2.093279
H -2.561542 0.617432 -2.048402


%chk=000202108-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202108

0 1
S 3.692666 -1.814936 0.729831
O -5.137506 -0.316480 0.833783
O -4.836675 0.887559 -1.083829
N 2.285739 0.276762 -0.124389
N 4.573506 0.767409 -0.119128
N -4.387124 0.200576 -0.084089
C 2.286195 1.732682 -0.423834
C 1.310804 -0.639058 0.313163
C 3.840444 2.005054 -0.583399
C 3.634620 -0.111911 0.091008
C -0.140177 -0.398565 0.204262
C 1.872372 -1.806085 0.797584
C -1.018761 -0.929396 1.193536
C -0.698643 0.336181 -0.881709
C -2.407781 -0.745719 1.102251
C -2.085905 0.533820 -0.982440
C -2.928003 -0.008918 0.013632
H 1.836859 2.302699 0.411098
H 1.733830 1.964506 -1.348907
H 4.103736 2.203615 -1.638251
H 4.167622 2.868749 0.019423
H 1.353511 -2.711566 1.100541
H -0.599452 -1.463007 2.052261
H -0.047196 0.719873 -1.671786
H -3.092460 -1.142806 1.856025
H -2.529722 1.086061 -1.814736


