%chk=000067263.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067263

0 1
 S  -0.8814000      -2.038200      -1.368600    
 O  -0.9552000      -3.463900      -1.109200    
 O  -0.7993000      -1.557700      -2.734500    
 O    2.020500       2.279600      -1.305300    
 O   -1.112600      0.5509000       3.027400    
 O    4.099900       1.699600     -0.5935000    
 O   -2.371300      -1.166500       2.232000    
 N   -2.171500      -1.253200     -0.5425000    
 N    3.872900     -1.6799999E-02   1.580800    
 C   0.5340000      -1.431000     -0.4963000    
 C   -2.128400      0.1692000     -0.3942000    
 C    1.147800     -0.2701000     -0.9310000    
 C   0.9977000      -2.130500      0.6033000    
 C    2.263000      0.2074000     -0.2424000    
 C    2.745400     -0.4840000      0.8689000    
 C   -1.980900      0.7561000      0.8627000    
 C    2.112800      -1.652800       1.291800    
 C   -2.237800      0.9715000      -1.530000    
 C   -1.942700       2.145200      0.9835000    
 C   -2.199400       2.360600      -1.409100    
 C   -2.051900       2.947400     -0.1524000    
 C    2.901300       1.431900     -0.7090000    
 C   -1.862900     -5.4600000E-02   2.067900    
 H   -2.581300      -1.767300      0.2474000    
 H   0.7738000      0.2511000      -1.807100    
 H   0.5137000      -3.036600      0.9539000    
 H    2.476700      -2.199900       2.157800    
 H   -2.372900      0.5360000      -2.516000    
 H   -1.841800       2.633900       1.949000    
 H   -2.289000       2.985400      -2.292900    
 H   -2.025700       4.029100     -5.8400001E-02
 H    4.345800      0.8320000       1.303400    
 H    4.206800     -0.5324000       2.384500    
 H    2.457500       3.100800      -1.617000    
 H   -1.036000     -2.2000000E-03   3.834000    


%chk=000067263-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000067263

0 1
S -0.678979 -1.799494 -0.986286
O -0.913881 -3.354517 -0.586611
O -0.900438 -1.238948 -2.495759
O 3.098297 1.583385 -2.579836
O -4.471853 0.496952 3.137256
O 4.974474 1.442652 -1.230018
O -3.374734 -1.332665 2.250494
N -1.786666 -0.953348 0.195703
N 4.905453 -0.290782 0.820378
C 1.039844 -1.298555 -0.437600
C -2.160039 0.387293 0.193595
C 1.733395 -0.332987 -1.162718
C 1.593382 -1.962976 0.682903
C 3.044574 0.027475 -0.753816
C 3.640962 -0.615576 0.397612
C -3.067582 0.859159 1.217056
C 2.882622 -1.618185 1.092583
C -1.673362 1.325703 -0.765198
C -3.430885 2.234821 1.257864
C -2.051465 2.675677 -0.694558
C -2.927032 3.146154 0.319242
C 3.798704 1.046018 -1.497904
C -3.614025 -0.083467 2.199361
H -2.265895 -1.596083 0.862487
H 1.298719 0.132307 -2.052016
H 1.024400 -2.743794 1.198019
H 3.333070 -2.121624 1.955048
H -1.042684 0.979284 -1.587577
H -4.118092 2.558788 2.044465
H -1.666847 3.371617 -1.448564
H -3.213642 4.201106 0.359972
H 5.425991 0.422564 0.293572
H 5.315650 -0.754266 1.627732
H 3.674667 2.252602 -3.036511
H -4.798506 -0.216293 3.748530


