%chk=000067181.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067181

0 1
 S    1.807800       2.230600     -0.1788000    
 O    1.907400       3.460600      0.5979000    
 O    2.125500       2.270500      -1.601100    
 O   -4.017900      -1.208100      -1.444200    
 N    2.772900       1.030500      0.5939000    
 N   -3.694600      0.1167000      0.4789000    
 N    2.062800      -1.156300       1.121500    
 N    2.977400     -0.6496000      -1.049700    
 C   0.1881000       1.608600      1.5000000E-02
 C  -0.3569000      0.7677000     -0.9555000    
 C  -0.5612000       1.952300       1.140300    
 C   -2.400100      0.6144000      0.3242000    
 C   -1.650900      0.2707000     -0.8010000    
 C   -1.855300       1.455200       1.294900    
 C    2.593400     -0.3404000      0.1981000    
 C    1.909000      -2.434200      0.7173000    
 C   -4.403500     -0.7321000     -0.3813000    
 C    2.260500      -2.889300     -0.5372000    
 C    2.795500      -1.943200      -1.387200    
 C    1.321800      -3.384600       1.706600    
 C   -5.781900      -1.039800      0.1477000    
 H   0.2091000      0.4866000      -1.839300    
 H  -0.1548000       2.599300       1.912500    
 H    2.872500       1.142800       1.611200    
 H   -2.003700     -0.3745000      -1.593300    
 H   -2.427300       1.729600       2.177600    
 H   -4.175400      0.4134000       1.325600    
 H    2.129400      -3.918800     -0.8447000    
 H    3.101000      -2.206700      -2.394200    
 H    1.097000      -2.879200       2.651700    
 H   0.3892000      -3.807800       1.320300    
 H    2.024000      -4.197500       1.917100    
 H   -5.701900      -1.559100       1.106700    
 H   -6.316200      -1.679800     -0.5600000    
 H   -6.344500     -0.1114000      0.2801000    


%chk=000067181-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067181

0 1
S 1.496419 1.744838 0.107303
O 1.749840 3.014791 1.093429
O 2.093408 1.718623 -1.395388
O -4.862857 -0.597466 -1.825330
N 2.218596 0.383572 1.140116
N -4.502824 0.807642 0.022785
N 3.369589 -1.628309 1.389568
N 1.688282 -1.353607 -0.374356
C -0.343304 1.386974 0.072055
C -0.869784 0.588210 -0.953518
C -1.128956 1.998323 1.063107
C -3.092845 0.973427 -0.001970
C -2.262906 0.377897 -0.993688
C -2.517562 1.782906 1.019164
C 2.437657 -0.911971 0.686744
C 3.565195 -2.929380 1.011485
C -5.313741 0.064986 -0.847808
C 2.846587 -3.479344 -0.082862
C 1.921315 -2.643070 -0.746340
C 4.581529 -3.717179 1.801177
C -6.804645 0.117997 -0.525750
H -0.204180 0.134233 -1.692138
H -0.667617 2.634783 1.824302
H 2.846142 0.753403 1.865314
H -2.716274 -0.236519 -1.772607
H -3.158326 2.249003 1.777714
H -4.987975 1.297642 0.777669
H 3.005508 -4.510857 -0.404874
H 1.339674 -3.007601 -1.600061
H 4.309569 -3.725011 2.871646
H 4.659602 -4.756371 1.442560
H 5.574239 -3.237865 1.727700
H -7.175951 -0.911103 -0.382581
H -7.342399 0.539574 -1.392499
H -7.052804 0.713927 0.369534


