%chk=000175826.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175826

0 1
 S    1.189500     -0.8223000      -2.570000    
 P    1.043400     -0.5652000     -0.6387000    
 O   0.6725000      0.9549000     -0.1856000    
 O  -0.1886000      -1.384100      3.9600000E-02
 O   -6.334500     -0.2698000      0.5239000    
 O   -5.639800       1.747900      8.3999997E-03
 N    2.362100     -0.9619000      0.2887000    
 N   -5.414200      0.5362000      0.2443000    
 C    3.653200     -0.3767000     -6.7599997E-02
 C    3.686500       1.100000      0.3416000    
 C    4.784600      -1.162200      0.6048000    
 C    5.049900       1.726600      5.4200001E-02
 C    6.146500     -0.5329000      0.3164000    
 C    6.180600      0.9406000      0.7119000    
 C  -0.6168000       1.461900     -0.5102000    
 C   -1.711000      0.4903000     -0.1665000    
 C   -1.456100     -0.8643000      7.7500001E-02
 C   -3.037000      0.9417000     -0.1160000    
 C   -2.491100      -1.744600      0.3962000    
 C   -4.076600      6.2600002E-02  0.1940000    
 C   -3.802900      -1.278900      0.4529000    
 H    3.808600     -0.4496000      -1.149900    
 H    3.457100       1.208100       1.409600    
 H    2.941800       1.679400     -0.2113000    
 H    4.784300      -2.201200      0.2529000    
 H    4.630400      -1.194600       1.691600    
 H    5.063200       2.761800      0.4139000    
 H    5.213700       1.762900      -1.029900    
 H    6.374100     -0.6295000     -0.7524000    
 H    6.926600      -1.078300      0.8594000    
 H    7.145500       1.376100      0.4292000    
 H    6.097900       1.027100       1.802300    
 H    2.235900     -0.9178000       1.299500    
 H  -0.6462000       1.703100      -1.577600    
 H  -0.7480000       2.388400      5.8200002E-02
 H   -3.230400       1.992600     -0.3218000    
 H   -2.282500      -2.792100      0.5956000    
 H   -4.586600      -1.990600      0.6996000    


%chk=000175826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000175826

0 1
S 1.411328 0.275944 -2.701608
P 1.015749 0.296699 -0.692235
O 0.147086 1.685507 -0.049409
O -0.144709 -0.952394 -0.108354
O -6.459258 -1.205051 0.641759
O -6.229492 1.009490 0.137221
N 2.289374 0.066530 0.392008
N -5.742988 -0.172987 0.335811
C 3.730461 0.067910 0.027168
C 4.368245 1.464156 0.233299
C 4.469941 -1.018801 0.842710
C 5.876845 1.440329 -0.113003
C 5.980226 -1.034394 0.499606
C 6.622788 0.358202 0.702884
C -1.224492 1.808188 -0.617092
C -2.088819 0.612583 -0.248066
C -1.520852 -0.680168 -0.031669
C -3.482832 0.758870 -0.119611
C -2.336138 -1.790252 0.301995
C -4.284369 -0.355220 0.206395
C -3.724682 -1.635694 0.422274
H 3.788450 -0.193468 -1.048402
H 4.232438 1.767772 1.291937
H 3.835829 2.206625 -0.390529
H 4.010913 -2.005364 0.646471
H 4.346676 -0.804608 1.926168
H 6.318838 2.437713 0.071407
H 5.999854 1.232085 -1.195867
H 6.110843 -1.347325 -0.556539
H 6.493540 -1.791872 1.121903
H 7.690227 0.329115 0.412231
H 6.589788 0.623638 1.779887
H 2.055513 0.028513 1.388365
H -1.143462 1.924227 -1.717803
H -1.620284 2.742187 -0.189337
H -3.965686 1.730399 -0.265139
H -1.853794 -2.759103 0.455992
H -4.377494 -2.474383 0.675872


