%chk=000066668.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000066668

0 1
 S   -1.058000      -2.532000      0.4326000    
 O    3.463000      -1.040600      -1.301300    
 O  -0.3852000      -2.545700       1.921200    
 O   -2.336900      -3.216300      0.5353000    
 O  -5.4299999E-02  -2.966900     -0.5239000    
 O   -4.579700       2.580700     -0.4745000    
 O   -5.259800      0.5432000     -2.1500001E-02
 N    1.006300     -0.3550000     -0.1119000    
 N   -4.342300       1.372200     -0.2340000    
 C  -0.3388000      5.8699999E-02 -0.1393000    
 C   -1.379600     -0.8441000      9.4499998E-02
 C    2.203600      0.3103000      0.2302000    
 C   -2.704800     -0.4095000      6.3199997E-02
 C  -0.6323000       1.398700     -0.4043000    
 C   -2.993500      0.9292000     -0.2018000    
 C   -1.957300       1.833200     -0.4356000    
 C    3.410700     -4.5400001E-02 -0.3716000    
 C    2.172000       1.332000       1.179500    
 C    4.586100      0.6208000     -2.4300000E-02
 C    3.347500       1.998000       1.526800    
 C    4.554400       1.642400      0.9250000    
 C    3.278800     -0.6638000      -2.664200    
 H    1.158200      -1.297700     -0.4572000    
 H   -3.510500      -1.114200      0.2483000    
 H   0.1505000       2.122200     -0.6158000    
 H   -2.145200       2.882000     -0.6508000    
 H    1.252300       1.614600       1.684000    
 H    5.530400      0.3487000     -0.4881000    
 H    3.324100       2.789500       2.270100    
 H    5.469800       2.159900       1.196600    
 H  -0.9552000      -2.197100       2.646400    
 H    3.327500      -1.567000      -3.278600    
 H    2.300000     -0.1956000      -2.808600    
 H    4.072400      1.9400001E-02  -2.982900    


%chk=000066668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000066668

0 1
S -1.220947 -2.499114 -0.025696
O 2.965349 -0.882481 -1.510040
O -0.830826 -2.664918 1.779436
O -2.564907 -3.325052 -0.360437
O 0.149232 -2.809113 -0.854130
O -4.862243 2.750472 0.257060
O -5.522193 0.560192 0.192371
N 0.855315 -0.144090 -0.131370
N -4.612052 1.480467 0.195141
C -0.454812 0.272340 -0.014249
C -1.545853 -0.664195 0.007942
C 2.036916 0.611077 0.083544
C -2.894037 -0.306503 0.076043
C -0.841113 1.656412 0.031584
C -3.206794 1.065283 0.121835
C -2.180228 2.043514 0.095491
C 3.195292 0.195597 -0.648175
C 2.162766 1.659587 1.025397
C 4.433501 0.845150 -0.463277
C 3.401317 2.315547 1.202921
C 4.530830 1.915302 0.456735
C 4.103639 -1.447300 -2.241073
H 1.009707 -1.102996 -0.499438
H -3.689512 -1.059058 0.090415
H -0.063112 2.419052 -0.037442
H -2.461801 3.099907 0.106058
H 1.309352 1.935129 1.651557
H 5.315555 0.529774 -1.027994
H 3.483059 3.123938 1.936171
H 5.491149 2.422410 0.595465
H -0.621876 -3.627869 1.960805
H 3.686286 -2.293028 -2.805319
H 4.532587 -0.704012 -2.939447
H 4.884657 -1.806619 -1.544383


