%chk=000128569.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128569

0 1
 S    2.285000      -2.167800       1.482600    
 S    3.888300      -2.687400      0.3060000    
 O   -8.161400       2.154500      0.2457000    
 O    7.519100       2.931500      0.3846000    
 O    6.319500       3.303100      -1.416000    
 N    6.639700       2.582800     -0.4397000    
 C  -0.3644000      -1.313100      0.7254000    
 C   -1.135500      -1.419300     -0.6109000    
 C   -2.615400      -1.063300     -0.4657000    
 C   -2.729000      0.4128000      2.0400001E-02
 C    1.028400      -1.774700      0.2298000    
 C  -0.4369000      0.1481000       1.190900    
 C  -0.7498000      -2.797300      -1.139200    
 C   -1.890300      0.6466000       1.304800    
 C   0.7127000      -2.978700     -0.6864000    
 C   -3.387600      -1.214100      -1.778200    
 C  -0.9168000      -2.237100       1.842700    
 C   -4.187300      0.8547000      0.1092000    
 C   -4.876000     -0.9844000      -1.533100    
 C   -5.178900      0.2116000     -0.6639000    
 C   -4.566500       1.962300      0.8881000    
 C   -6.512700      0.6518000     -0.5988000    
 C   -5.893500       2.394500      0.9368000    
 C   -6.867900       1.736700      0.1972000    
 C    4.706200      -1.117800      8.4799998E-02
 C    5.685700     -0.7103000      0.9891000    
 C    4.365700     -0.3015000     -0.9927000    
 C    6.326400      0.5164000      0.8154000    
 C    5.006400      0.9252000      -1.166300    
 C    5.986800       1.334200     -0.2623000    
 H  -0.7062000     -0.6925000      -1.321100    
 H   -3.084300      -1.731000      0.2680000    
 H   -2.285600       1.053900     -0.7575000    
 H    1.447800     -0.9709000     -0.3894000    
 H   9.4800003E-02  0.7944000      0.4803000    
 H   6.8400003E-02  0.2728000       2.156100    
 H  -0.8367000      -2.856800      -2.228900    
 H   -1.383000      -3.583400     -0.7127000    
 H   -2.383200      0.1722000       2.162000    
 H   -1.842800       1.717200       1.535700    
 H   0.8122000      -3.943600     -0.1755000    
 H    1.379300      -2.992300      -1.556100    
 H   -3.250700      -2.212600      -2.207900    
 H   -3.015400     -0.4943000      -2.518700    
 H  -0.3654000      -2.090800       2.778400    
 H   -1.967300      -2.042300       2.073400    
 H  -0.8407000      -3.297900       1.584000    
 H   -5.297500      -1.871100      -1.042400    
 H   -5.377500     -0.8757000      -2.502500    
 H   -3.836300       2.518100       1.468400    
 H   -7.279400      0.1412000      -1.178300    
 H   -6.149400       3.250800       1.555300    
 H   -8.224100       2.917500      0.8458000    
 H    5.963800      -1.334700       1.834600    
 H    3.607300     -0.6048000      -1.710100    
 H    7.085300      0.8024000       1.539200    
 H    4.716800       1.535700      -2.017800    


%chk=000128569-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128569

0 1
S 2.305361 -2.686167 1.152398
S 4.152040 -2.639503 -0.151273
O -7.795061 2.680354 0.711586
O 5.559349 4.015604 0.535780
O 7.189133 3.388354 -0.935292
N 6.165026 3.130444 -0.187965
C -0.304931 -1.631206 0.498244
C -1.254169 -1.728946 -0.745904
C -2.669962 -1.205667 -0.444645
C -2.563670 0.292304 -0.016229
C 0.965226 -2.262419 -0.146302
C -0.181614 -0.145557 0.905560
C -1.052422 -3.175847 -1.270148
C -1.575560 0.487992 1.170452
C 0.453495 -3.492067 -0.955393
C -3.636422 -1.323568 -1.642393
C -0.782355 -2.491872 1.700290
C -3.952930 0.908776 0.220570
C -5.065411 -0.933924 -1.212951
C -5.121012 0.346112 -0.380737
C -4.106559 2.087318 0.993921
C -6.378544 0.963948 -0.193368
C -5.359454 2.705828 1.183802
C -6.503522 2.133470 0.581958
C 4.686058 -0.882010 -0.107570
C 4.059517 0.114646 0.677673
C 5.806345 -0.556698 -0.920919
C 4.544574 1.434778 0.653523
C 6.296715 0.759933 -0.947919
C 5.657157 1.745003 -0.159936
H -0.821057 -1.044157 -1.512429
H -3.104951 -1.790693 0.394273
H -2.114039 0.821158 -0.890158
H 1.445417 -1.520137 -0.809293
H 0.320398 0.413104 0.087284
H 0.451246 -0.036491 1.808492
H -1.273803 -3.259533 -2.348191
H -1.720892 -3.883016 -0.744269
H -2.023398 0.068343 2.092440
H -1.426113 1.566799 1.363392
H 0.552926 -4.413610 -0.356325
H 1.054394 -3.634305 -1.870312
H -3.638912 -2.355734 -2.041185
H -3.286232 -0.659153 -2.459122
H -0.052318 -2.425762 2.530367
H -1.751307 -2.144987 2.095843
H -0.891916 -3.557242 1.433384
H -5.497000 -1.762416 -0.612913
H -5.719907 -0.826530 -2.099044
H -3.230581 2.546610 1.462585
H -7.279502 0.542222 -0.652495
H -5.439989 3.618658 1.788378
H -7.773784 3.499207 1.266211
H 3.205042 -0.152522 1.308886
H 6.291707 -1.327954 -1.528630
H 4.081974 2.223762 1.252355
H 7.156401 1.036467 -1.563736


