%chk=000095190.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095190

0 1
 S   -1.229300     -0.9689000     -0.2133000    
 N    1.999900      -1.730200     -0.1485000    
 N   6.4999998E-02   1.391300      4.6399999E-02
 N    3.750400     -0.3635000      4.2599998E-02
 N    2.481000       1.705900      0.1725000    
 C   -3.987900     -0.2889000     -0.2659000    
 C   -2.559600      0.2719000     -0.1585000    
 C   -4.314200      -1.292800      0.8419000    
 C   -5.051900      0.8091000     -0.3269000    
 C    1.478900     -0.4708000     -5.9300002E-02
 C   0.2217000      6.6100001E-02 -6.3400000E-02
 C    2.585100      0.3599000      5.8499999E-02
 C    3.363400      -1.614900     -8.2900003E-02
 C    1.197600       2.125800      0.1570000    
 H   -4.055700     -0.8326000      -1.218700    
 H   -2.398600      0.9765000     -0.9826000    
 H   -2.470200      0.8336000      0.7789000    
 H   -4.197600     -0.8371000       1.831000    
 H   -5.348800      -1.642900      0.7542000    
 H   -3.672800      -2.177700      0.7949000    
 H   -5.064400       1.394700      0.5984000    
 H   -6.049300      0.3814000     -0.4735000    
 H   -4.855100       1.493500      -1.158800    
 H    1.477900      -2.591100     -0.2452000    
 H    4.011800      -2.478100     -0.1322000    
 H    1.052800       3.197200      0.2451000    


%chk=000095190-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095190

0 1
S -1.178539 -0.928713 1.322143
N 2.030664 -1.652083 0.518500
N -0.290819 1.192025 -0.237133
N 3.500839 -0.418048 -0.736852
N 1.941671 1.458877 -1.226468
C -3.549947 -0.031586 -0.064567
C -2.690349 0.218297 1.191059
C -4.206363 -1.429626 -0.057227
C -4.617776 1.087785 -0.160379
C 1.333156 -0.509199 0.124907
C 0.029232 -0.000525 0.323899
C 2.265106 0.255083 -0.660632
C 3.316753 -1.541855 -0.025819
C 0.668268 1.855043 -0.974208
H -2.884205 0.051912 -0.945534
H -2.276656 1.240175 1.193529
H -3.251394 0.030419 2.124012
H -4.895472 -1.536034 0.803323
H -4.792132 -1.591004 -0.980519
H -3.446734 -2.229874 0.008916
H -5.292051 1.071055 0.717730
H -5.239575 0.949942 -1.063636
H -4.149033 2.087220 -0.217680
H 1.672916 -2.417843 1.088864
H 4.076333 -2.305854 0.127612
H 0.356206 2.811809 -1.402140


