%chk=000175544.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175544

0 1
 S   -3.304500     -0.6692000      0.1328000    
 S  -3.1900000E-02  -2.626500     -0.8484000    
 P   -1.298700     -6.6299997E-02 -0.1514000    
 O  -0.5902000     -0.1428000       1.177100    
 O   0.7270000      -2.452600      0.3752000    
 O   -1.121600      -3.581400     -0.9131000    
 O   0.2262000       3.208500      -1.729600    
 O    1.624400       1.602800      0.3872000    
 O    1.745300      0.5556000      -1.716200    
 N  -0.5771000      -1.088600      -1.411600    
 N   -1.185400       1.535000     -0.8545000    
 C   -3.851900      0.1381000       1.649900    
 C   -5.380900      0.2701000       1.709300    
 C   -3.329300     -0.6587000       2.843100    
 C   -1.244900      -1.067300      -2.739600    
 C   -2.396900       2.301800      -1.124900    
 C   -5.978300       1.055400      0.5480000    
 C    1.110700      -3.070900      -2.137200    
 C   3.5399999E-02   2.115400      -1.209300    
 C    1.269600       1.328200     -0.9074000    
 C    2.776000      0.9105000      0.7708000    
 C    3.972800       1.111900      8.3099999E-02
 C    2.728900      1.7500000E-02   1.841400    
 C    5.122200      0.4203000      0.4656000    
 C    3.878200     -0.6741000       2.223900    
 C    5.074900     -0.4726000       1.536000    
 H   -3.413100       1.140900       1.682000    
 H   -5.851200     -0.7208000       1.750000    
 H   -5.653900      0.7788000       2.642600    
 H   -2.239200     -0.7115000       2.876200    
 H   -3.648100     -0.1847000       3.778700    
 H   -3.721000      -1.682600       2.850500    
 H  -0.5044000      -1.203500      -3.531300    
 H   -1.731400     -0.1047000      -2.910500    
 H   -2.008900      -1.846200      -2.803800    
 H   -3.055800       1.708500      -1.763000    
 H   -2.178000       3.246200      -1.629500    
 H   -2.888500       2.518700     -0.1744000    
 H    1.856600      -2.280900      -2.239600    
 H   0.5699000      -3.231700      -3.070600    
 H    1.602300      -4.000200      -1.839400    
 H   -5.497200       2.033300      0.4460000    
 H   -5.888800      0.5211000     -0.4021000    
 H   -7.045700       1.224100      0.7252000    
 H    4.030100       1.815500     -0.7432000    
 H    1.805000     -0.1398000       2.389400    
 H    6.054800      0.5797000     -6.7699999E-02
 H    3.841900      -1.368000       3.058600    
 H    5.970100      -1.010200       1.834800    


%chk=000175544-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000175544

0 1
S -3.788365 -0.154857 -0.590301
S -0.249801 -2.557576 -0.271718
P -1.549062 0.267233 -0.359386
O -1.037968 0.319966 1.156828
O -1.574054 -3.004279 0.560055
O 0.367925 -3.566211 -1.382192
O -0.125244 3.073395 -2.860770
O 1.538356 1.426784 -0.592877
O 1.702801 0.666860 -2.830628
N -0.581613 -0.903218 -1.295335
N -1.346167 1.727578 -1.393885
C -4.093757 -1.009885 1.140329
C -4.939971 -0.080934 2.032227
C -4.740821 -2.374686 0.861751
C -0.991351 -1.246278 -2.682283
C -2.489869 2.683352 -1.481781
C -4.275241 1.265034 2.382157
C 1.092863 -1.989171 0.940501
C -0.178967 2.077330 -2.090291
C 1.100455 1.240501 -1.905743
C 2.775411 0.948505 -0.053362
C 3.769948 0.257311 -0.784439
C 2.921869 1.234159 1.322274
C 4.937745 -0.148910 -0.095149
C 4.094552 0.820081 1.986981
C 5.106822 0.125729 1.280603
H -3.080314 -1.138369 1.560504
H -5.929755 0.085732 1.562815
H -5.130996 -0.649082 2.967389
H -4.060901 -3.017033 0.280336
H -4.946137 -2.877241 1.826939
H -5.700281 -2.271124 0.323038
H -0.500680 -2.202468 -2.946473
H -0.596622 -0.478822 -3.369365
H -2.087307 -1.352742 -2.796073
H -3.240491 2.339404 -2.212581
H -2.086273 3.651940 -1.813058
H -2.965672 2.789681 -0.494375
H 0.647840 -1.132903 1.469271
H 1.960911 -1.715849 0.327311
H 1.277581 -2.862095 1.583153
H -3.255896 1.113916 2.780407
H -4.192174 1.905805 1.485574
H -4.870466 1.811770 3.135627
H 3.641802 0.048861 -1.847187
H 2.120867 1.769482 1.840388
H 5.718663 -0.682283 -0.647824
H 4.217317 1.041133 3.052471
H 6.017989 -0.193423 1.797246


