%chk=000152610.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152610

0 1
 S    5.528000      0.3168000      -1.282300    
 O    1.487100     -0.7910000       2.947600    
 O    6.745100     -0.1531000      -1.917700    
 O    4.628400       1.210800      -1.983900    
 N  -0.6044000     -0.2921000       1.132500    
 N   -4.175300      0.4766000     -0.9283000    
 N    4.679300      -1.045400     -0.6577000    
 N   -4.242400      -3.174400     -0.9021000    
 C   -1.813700     -3.0700000E-02  0.4344000    
 C   -2.203700       1.290200      0.1874000    
 C   -2.606000      -1.098000     -8.9999998E-04
 C   -3.408200       1.500600     -0.5071000    
 C   0.7145000     -0.4809000      0.6974000    
 C   -3.789500     -0.7922000     -0.6844000    
 C    1.746300     -0.7284000       1.610900    
 C   -1.427400       2.382100      0.6129000    
 C    3.340500     -0.8542000     -0.1999000    
 C    1.010400     -0.4221000     -0.6697000    
 C   -2.249700      -2.433600      0.2265000    
 C    3.054400     -0.9144000       1.163900    
 C   -3.800000       2.813300     -0.7555000    
 C    2.318600     -0.6079000      -1.116800    
 C   -1.841800       3.684700      0.3517000    
 C   -4.551200      -1.871000      -1.101800    
 C   -3.030500       3.900400     -0.3340000    
 C   -3.095300      -3.423100     -0.2407000    
 C    6.011100       1.108900      0.2354000    
 C    1.575500      0.4280000       3.682100    
 H  -0.7410000     -0.3870000       2.134500    
 H  -0.4949000       2.249500       1.155100    
 H   0.2354000     -0.2349000      -1.408500    
 H   -1.346600      -2.721600      0.7539000    
 H    3.848500      -1.105800       1.882000    
 H   -4.727500       3.008600      -1.290800    
 H    2.523400     -0.5711000      -2.183600    
 H   -1.240700       4.526200      0.6823000    
 H   -5.483200      -1.713400      -1.638600    
 H    5.237700      -1.672600     -6.3199997E-02
 H   -3.362800       4.913100     -0.5426000    
 H   -2.864500      -4.472000     -8.8500001E-02
 H    6.628800       1.973200     -1.9200001E-02
 H    5.119500       1.441100      0.7696000    
 H    6.591400      0.4054000      0.8354000    
 H   0.8775000       1.172900       3.287300    
 H    2.597400      0.8190000       3.651100    
 H    1.312400      0.2204000       4.722800    


%chk=000152610-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000152610

0 1
S 5.678731 1.248289 -0.939204
O 1.211647 -1.234680 2.735672
O 7.281826 1.003908 -1.088874
O 4.809638 1.985029 -2.100503
N -0.604422 -0.480342 1.006611
N -4.320808 0.580500 -0.907000
N 4.803997 -0.620261 -0.675490
N -5.220779 -2.725202 0.400861
C -1.793796 -0.101962 0.344682
C -1.970543 1.172313 -0.287781
C -2.901096 -1.011876 0.378027
C -3.256603 1.445449 -0.932064
C 0.719453 -0.447490 0.545993
C -4.148062 -0.604454 -0.247462
C 1.730303 -0.861493 1.480700
C -0.982715 2.218235 -0.269770
C 3.472168 -0.557321 -0.219136
C 1.117860 -0.115845 -0.776600
C -2.862116 -2.322445 0.967308
C 3.084206 -0.884152 1.121864
C -3.448370 2.705141 -1.602436
C 2.467909 -0.173281 -1.156044
C -1.215260 3.433229 -0.908563
C -5.266146 -1.517898 -0.180810
C -2.451394 3.674079 -1.600414
C -4.005885 -3.117634 0.958588
C 5.395682 2.292665 0.667253
C 2.149821 -1.728280 3.747221
H -0.708276 -0.973403 1.900188
H -0.040551 2.059475 0.261042
H 0.361129 0.162483 -1.514252
H -1.937204 -2.719894 1.398899
H 3.850713 -1.179889 1.846957
H -4.413989 2.862169 -2.092140
H 2.774896 0.061482 -2.178547
H -0.450821 4.217041 -0.881372
H -6.211539 -1.201565 -0.635436
H 5.462182 -1.039750 0.013159
H -2.608780 4.630517 -2.110111
H -3.998968 -4.121836 1.394781
H 5.724517 3.307961 0.405168
H 4.320257 2.247153 0.887047
H 6.019010 1.840534 1.450716
H 2.875081 -0.941565 4.029251
H 2.687879 -2.624511 3.384095
H 1.530115 -1.989726 4.616825


