%chk=000033295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033295

0 1
 S  -0.8839000       2.356800     -0.1372000    
 S   0.5831000       1.744100       1.174400    
 S  -0.9361000     -4.2300001E-02  -1.969300    
 S    2.618900       2.888900     -0.7389000    
 N   -5.236700      -1.360200      2.1900000E-02
 N    5.230600      -1.248200     -0.2507000    
 N   -2.560400      0.3742000      9.8800004E-02
 N    2.491500      0.3545000      6.7199998E-02
 C   -4.797400      0.8033000       1.206600    
 C    3.312900      -1.702200       1.296200    
 C   -5.592900      6.2500000E-02  0.1282000    
 C    4.790400      -1.327900       1.150200    
 C   -3.448500       1.335300      0.7345000    
 C    2.356600     -0.5166000       1.224600    
 C   -3.902900      -1.598700     -0.5474000    
 C    4.684400     -9.5799997E-02 -0.9812000    
 C   -2.758500      -1.053700      0.3081000    
 C    3.163100     -0.1243000      -1.133400    
 C   -6.244300      -2.065200     -0.7784000    
 C    6.696200      -1.215700     -0.3091000    
 C   -1.533200      0.8212000     -0.6744000    
 C    1.967400       1.610000      0.1093000    
 H   -4.671100      0.1628000       2.088700    
 H   -5.391100       1.661000       1.549100    
 H    3.171100      -2.184900       2.272000    
 H    3.040800      -2.460800      0.5512000    
 H   -6.647100      0.1301000      0.4283000    
 H   -5.510000      0.5724000     -0.8403000    
 H    5.017100     -0.4039000       1.697400    
 H    5.356900      -2.130000       1.641900    
 H   -3.632400       2.165100      3.9900001E-02
 H   -2.936500       1.739900       1.616300    
 H    1.336700     -0.9214000       1.227600    
 H    2.491200      7.5900003E-02   2.138600    
 H   -3.848300      -1.213500      -1.573100    
 H   -3.753100      -2.684700     -0.6073000    
 H    5.096600     -0.1177000      -1.998600    
 H    5.018900      0.8432000     -0.5231000    
 H   -2.936400      -1.229400       1.376200    
 H   -1.841100      -1.609700      8.4700003E-02
 H    2.874800      0.4741000      -2.004700    
 H    2.800800      -1.135200      -1.357800    
 H   -6.027400      -3.138700     -0.8171000    
 H   -6.294500      -1.684600      -1.805100    
 H   -7.236900      -1.968200     -0.3243000    
 H    7.122500      -2.109900      0.1592000    
 H    7.108600     -0.3323000      0.1921000    
 H    7.043200      -1.217800      -1.348600    


%chk=000033295-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000033295

0 1
S -0.927663 1.107636 -2.383305
S 0.380806 2.557166 -0.859175
S -1.496309 -1.790121 -2.525509
S 2.961921 3.587886 -0.142365
N -4.921945 -1.183190 0.948073
N 4.685969 -1.105530 0.473416
N -2.063833 -0.320127 -0.264427
N 2.737287 0.989676 -1.054234
C -3.572772 0.911727 1.366703
C 2.683817 -1.554496 -1.014146
C -4.848630 0.288385 0.752250
C 3.308816 -1.657893 0.396756
C -2.339710 0.966395 0.440232
C 1.936302 -0.243538 -1.322554
C -3.955143 -1.955187 0.134659
C 4.769025 0.364030 0.321098
C -2.482033 -1.580108 0.406565
C 4.221723 0.874272 -1.028740
C -6.296731 -1.700656 0.770771
C 5.397967 -1.559215 1.687520
C -1.556934 -0.378071 -1.531659
C 2.166126 2.180455 -0.748489
H -3.352647 0.375778 2.307787
H -3.781793 1.962894 1.645529
H 1.922303 -2.349797 -1.131439
H 3.470248 -1.765513 -1.760768
H -5.727845 0.720774 1.264397
H -4.929629 0.575656 -0.328146
H 2.622615 -1.183043 1.147397
H 3.383201 -2.727928 0.665598
H -2.494550 1.731032 -0.342661
H -1.447413 1.275699 1.017212
H 1.586035 -0.246271 -2.370737
H 1.035408 -0.188106 -0.685286
H -4.137387 -1.858276 -0.964164
H -4.083271 -3.024409 0.391328
H 5.838927 0.641845 0.377759
H 4.245018 0.917109 1.141046
H -2.312727 -1.475329 1.491993
H -1.837539 -2.386038 0.013476
H 4.628101 1.881183 -1.224057
H 4.537438 0.199251 -1.841739
H -6.322572 -2.776771 1.020040
H -6.688474 -1.581127 -0.270004
H -6.983277 -1.175416 1.458250
H 5.404562 -2.663097 1.723903
H 4.944021 -1.184263 2.639005
H 6.446792 -1.213536 1.654039


