%chk=000227396.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227396

0 1
 S   -1.790200       1.060500     -0.2100000    
 O    2.105300     -8.8999998E-03   2.089800    
 C  -0.1283000      0.9935000      0.5633000    
 C   0.4428000     -0.4262000      0.3853000    
 C   0.7517000       2.107100      2.5900001E-02
 C    1.820000     -0.6302000       1.048400    
 C   -2.513800     -0.3552000      0.6440000    
 C   0.7060000       3.349500      0.6294000    
 C    1.575600       1.850000      -1.053400    
 C    2.786500      -1.531000      0.4409000    
 C   -3.938700     -0.6000000      0.2301000    
 C    1.514400       4.373200      0.1352000    
 C    2.384100       2.873600      -1.547600    
 C    2.353500       4.135200     -0.9533000    
 C    2.347700      -2.632100     -0.2945000    
 C    4.152500      -1.294100      0.5939000    
 C   -4.205800      -1.440400     -0.8429000    
 C   -4.969900      1.7500000E-02  0.9255000    
 C    3.274900      -3.496300     -0.8768000    
 C    5.079800      -2.158100      1.1400000E-02
 C   -5.527400      -1.667100      -1.227200    
 C   -6.291500     -0.2093000      0.5414000    
 C    4.640900      -3.259200     -0.7239000    
 C   -6.570200      -1.051600     -0.5350000    
 H  -0.2657000       1.166300       1.639000    
 H  -0.1559000      -1.171800      0.9137000    
 H   0.4822000     -0.7095000     -0.6717000    
 H   -2.455900     -0.2118000       1.728900    
 H   -1.985700      -1.279500      0.4023000    
 H   5.5700000E-02   3.545000       1.477000    
 H    1.612400      0.8912000      -1.557300    
 H    1.490200       5.355600      0.5976000    
 H    3.034000       2.690200      -2.398300    
 H    2.982000       4.932500      -1.339000    
 H    1.291300      -2.855100     -0.4149000    
 H    4.514000     -0.4388000       1.158900    
 H   -3.402700      -1.924400      -1.391800    
 H   -4.764100      0.6760000       1.764700    
 H    2.933700      -4.356300      -1.445700    
 H    6.143500      -1.973200      0.1295000    
 H   -5.744500      -2.322500      -2.065700    
 H   -7.103600      0.2701000       1.080100    
 H    5.362900      -3.932500      -1.176700    
 H   -7.599200      -1.228000     -0.8342000    


%chk=000227396-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227396

0 1
S -1.757365 0.717100 -0.624846
O 2.061737 0.012562 1.889173
C -0.013666 0.820652 0.176888
C 0.816591 -0.437785 -0.159551
C 0.644150 2.112587 -0.282600
C 1.992867 -0.644736 0.808069
C -2.561376 -0.546539 0.573889
C 1.074093 3.070868 0.668865
C 0.849974 2.377871 -1.662551
C 3.038525 -1.669908 0.469935
C -4.041167 -0.646791 0.288012
C 1.696512 4.269350 0.252512
C 1.466579 3.577106 -2.080259
C 1.893896 4.527446 -1.123360
C 2.963946 -2.489841 -0.688851
C 4.137501 -1.826349 1.358884
C -4.553852 -1.691292 -0.523243
C -4.943596 0.311389 0.819865
C 3.968082 -3.446661 -0.950386
C 5.141354 -2.777657 1.094659
C -5.938395 -1.782426 -0.791900
C -6.327291 0.222038 0.554266
C 5.058872 -3.591588 -0.061564
C -6.829632 -0.826349 -0.252552
H -0.178167 0.861335 1.267021
H 0.182669 -1.347230 -0.104283
H 1.180086 -0.382706 -1.201551
H -2.367275 -0.172087 1.593836
H -2.060601 -1.520470 0.440078
H 0.936340 2.865077 1.736128
H 0.506176 1.653892 -2.412160
H 2.028738 4.998099 1.000508
H 1.610368 3.773271 -3.148932
H 2.373903 5.457883 -1.447050
H 2.126279 -2.389788 -1.386929
H 4.175694 -1.187437 2.247503
H -3.865218 -2.433543 -0.945265
H -4.554881 1.130274 1.436843
H 3.903215 -4.076557 -1.844250
H 5.986221 -2.888707 1.782967
H -6.320360 -2.596411 -1.418306
H -7.012563 0.967110 0.973889
H 5.839114 -4.332671 -0.268425
H -7.903577 -0.896483 -0.458674


