%chk=000227261.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227261

0 1
 S   -1.254200      0.8204000      0.7633000    
 O   0.8951000       2.571800       1.723700    
 O   -4.248200      0.1421000      0.1760000    
 N    2.562500       2.098700      0.2343000    
 N   -3.553000      -2.041700      0.3508000    
 C   0.4015000      0.9763000     -8.3700001E-02
 C   0.1549000       1.565900      -1.506500    
 C    1.039700     -0.4269000     -8.3999999E-02
 C    1.280100       1.958500      0.7294000    
 C  -0.5088000       2.942500      -1.568200    
 C    1.231800      -1.051200       1.120900    
 C    1.384400     -0.9813000      -1.289200    
 C   -1.965500     -0.3747000     -0.3805000    
 C    1.809600      -2.320800       1.120600    
 C    1.961900      -2.251000      -1.289500    
 C    2.174500      -2.920900     -8.4700003E-02
 C   -3.366500     -0.7076000      6.7400001E-02
 H    1.123800       1.691100      -2.010800    
 H  -0.4108000      0.8929000      -2.158000    
 H  -0.5283000       3.295300      -2.605200    
 H   -1.544100       2.914900      -1.217500    
 H   3.9900001E-02   3.683600     -0.9798000    
 H   0.9713000     -0.5963000       2.071000    
 H    1.250300     -0.5067000      -2.252100    
 H   -2.078900      3.5100002E-02  -1.386400    
 H   -1.376400      -1.292200     -0.4356000    
 H    1.978900      -2.840900       2.058900    
 H    2.248200      -2.718100      -2.227400    
 H    3.227200       2.718600      0.6853000    
 H    2.895500       1.594100     -0.5806000    
 H    2.625500      -3.908900     -8.4799998E-02
 H   -4.455000      -2.384200      0.6648000    
 H   -2.814200      -2.731800      0.2617000    


%chk=000227261-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227261

0 1
S -1.525063 0.992660 0.426187
O 0.477355 2.656204 1.613802
O -3.877399 -2.136948 -0.728331
N 2.436477 1.882628 0.648093
N -2.845777 -1.604783 1.292941
C 0.302587 1.020797 -0.256615
C 0.312557 1.735926 -1.641959
C 0.868345 -0.402709 -0.281626
C 1.059454 1.913762 0.773717
C -0.116299 3.215359 -1.609803
C 1.075321 -1.089197 0.948915
C 1.181682 -1.080030 -1.488873
C -2.292342 -0.295147 -0.741982
C 1.585873 -2.400994 0.971790
C 1.689527 -2.401373 -1.467456
C 1.893876 -3.066680 -0.240405
C -3.081890 -1.420572 -0.050112
H 1.335572 1.661209 -2.065387
H -0.355776 1.176934 -2.325625
H -0.155595 3.618657 -2.637723
H -1.113920 3.324075 -1.150658
H 0.590110 3.833246 -1.027894
H 0.825160 -0.583150 1.889321
H 1.039157 -0.586138 -2.455008
H -2.972827 0.211647 -1.442722
H -1.481574 -0.771329 -1.321365
H 1.738847 -2.909813 1.930039
H 1.917785 -2.908629 -2.411369
H 2.990672 2.479054 1.262537
H 2.906711 1.207570 0.046092
H 2.282779 -4.090614 -0.224739
H -3.334412 -2.354019 1.780917
H -2.204274 -0.981004 1.788903


