%chk=000029081.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029081

0 1
 S   -6.224800      0.4039000     -0.2484000    
 N    5.716500     -0.1954000      0.1608000    
 N   0.1796000      0.1592000     -0.5891000    
 N   -4.844300      -1.737000      0.1547000    
 N  -0.3936000      0.3083000      0.5153000    
 C    4.321600     -0.1063000     -2.7899999E-02
 C    3.539600      -1.261300     -7.3000002E-03
 C    3.723900       1.136900     -0.2353000    
 C    1.569400      6.9499999E-02 -0.4007000    
 C   -3.950600     -0.6760000      0.1587000    
 C   -4.521800      0.5834000     -4.7100000E-02
 C    2.160100      -1.173100     -0.1942000    
 C    2.344400       1.225000     -0.4221000    
 C   -1.777000      0.3978000      0.3271000    
 C   -2.554400     -0.7638000      0.3484000    
 C    6.439200      -1.380800     -0.2551000    
 C    6.447400      0.9032000      0.7607000    
 C   -3.747100       1.754300     -6.9700003E-02
 C   -2.367800       1.639400      0.1206000    
 C   -6.060300      -1.287000     -4.9600001E-02
 H    3.971600      -2.243300      0.1635000    
 H    4.304600       2.054200     -0.2693000    
 H    1.557800      -2.077500     -0.1749000    
 H    1.886800       2.196900     -0.5864000    
 H   -2.091900      -1.734100      0.5107000    
 H    6.323500      -2.183900      0.4802000    
 H    6.096500      -1.737000      -1.233200    
 H    7.511400      -1.176400     -0.3529000    
 H    6.634500       1.692600      2.5100000E-02
 H    7.419800      0.5699000       1.140400    
 H    5.905900       1.327600       1.613700    
 H   -4.201500       2.727100     -0.2302000    
 H   -1.758400       2.540400      0.1059000    
 H   -6.916400      -1.946200     -9.0999998E-02


%chk=000029081-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000029081

0 1
S -6.517161 0.125860 0.027255
N 5.852446 -0.080867 0.069060
N 0.192856 0.091594 -0.319111
N -4.710341 0.561747 -1.930641
N -0.525673 -0.152436 0.755747
C 4.461402 -0.045449 -0.001322
C 3.653885 -0.304904 1.161637
C 3.786592 0.250443 -1.232542
C 1.594936 0.026376 -0.134469
C -3.962964 0.269490 -0.762949
C -4.752587 0.003075 0.409843
C 2.258814 -0.269726 1.094715
C 2.387472 0.283537 -1.287712
C -1.940151 -0.077136 0.541254
C -2.557357 0.229550 -0.698569
C 6.524437 -0.382593 1.341986
C 6.658699 0.183562 -1.131665
C -4.143116 -0.302461 1.644262
C -2.737111 -0.339315 1.697266
C -5.999738 0.530371 -1.703776
H 4.131179 -0.534294 2.118517
H 4.357326 0.454273 -2.142021
H 1.647993 -0.467337 1.981250
H 1.869402 0.509646 -2.225885
H -1.946260 0.430097 -1.582080
H 6.274512 0.362287 2.123500
H 6.249489 -1.386249 1.722943
H 7.615032 -0.364025 1.192815
H 6.446598 -0.549145 -1.935770
H 7.727730 0.110534 -0.878959
H 6.471468 1.198913 -1.534726
H -4.737790 -0.505815 2.539346
H -2.215522 -0.571243 2.631248
H -6.772297 0.722142 -2.449047


