%chk=000011134.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011134

0 1
 S   -7.208200     -0.3859000      0.1165000    
 O   -7.704300      -1.178700      -1.224600    
 O   -7.486400      -1.255300       1.250500    
 O   -7.747200      0.9644000      6.7699999E-02
 N    4.715100       1.129600      4.0700000E-02
 N  -0.8419000      0.6862000      0.5584000    
 N   -1.318200      8.3999999E-02 -0.4324000    
 C    3.315100       1.017700      0.1712000    
 C    5.741800      0.1726000     -7.5099997E-02
 C   -5.475500     -0.2490000     -4.6200000E-02
 C    2.485300       2.016200     -0.3386000    
 C    2.760500     -9.1200002E-02  0.8102000    
 C   0.5461000      0.7967000      0.4292000    
 C   -2.713200     -2.7100001E-02 -0.3020000    
 C    1.100800       1.905700     -0.2096000    
 C    1.376000     -0.2017000      0.9391000    
 C   -4.921000      0.8607000     -0.6839000    
 C   -4.645500      -1.247500      0.4633000    
 C   -3.536500      0.9719000     -0.8121000    
 C   -3.261000      -1.136300      0.3350000    
 C    7.018200      0.4535000      0.4155000    
 C    5.485600      -1.059300     -0.6796000    
 C    8.035000     -0.4946000      0.3020000    
 C    6.502400      -2.007400     -0.7931000    
 C    7.777200      -1.725000     -0.3022000    
 H    5.047800       2.089700      2.7200000E-02
 H    2.905600       2.884800     -0.8392000    
 H    3.383000     -0.8729000       1.236600    
 H   0.4625000       2.689200     -0.6098000    
 H   0.9533000      -1.066900       1.443400    
 H   -5.547300       1.647200      -1.095500    
 H   -5.055300      -2.123800      0.9575000    
 H   -3.112700       1.838400      -1.312700    
 H   -2.621500      -1.919800      0.7326000    
 H    7.231700       1.408200      0.8895000    
 H    4.508700      -1.298600      -1.090600    
 H    9.027700     -0.2749000      0.6841000    
 H    6.303300      -2.963500      -1.268100    
 H    8.569200      -2.462700     -0.3917000    
 H   -7.345400      -2.090800      -1.333600    


%chk=000011134-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000011134

0 1
S -7.448269 -0.417998 0.141787
O -7.641750 -0.963287 -1.629384
O -7.958859 -1.617138 1.101527
O -8.072651 1.068841 0.283797
N 4.856126 1.169968 -0.112432
N -0.795475 0.855232 -0.152349
N -1.381133 -0.277858 0.177107
C 3.465548 1.014029 -0.122787
C 5.876956 0.181657 -0.049668
C -5.583573 -0.345020 0.124795
C 2.662459 2.135700 -0.498445
C 2.813073 -0.198040 0.275869
C 0.617347 0.832676 -0.116510
C -2.810368 -0.221155 0.135413
C 1.266294 2.043961 -0.492236
C 1.418162 -0.283772 0.277439
C -4.973929 0.869621 -0.244414
C -4.877212 -1.500396 0.498566
C -3.570074 0.928576 -0.234613
C -3.470809 -1.425574 0.502955
C 7.122046 0.541642 0.535400
C 5.721686 -1.116139 -0.608783
C 8.186493 -0.381807 0.570308
C 6.789600 -2.036439 -0.554652
C 8.025312 -1.680968 0.034287
H 5.188925 2.136286 -0.145995
H 3.148903 3.070157 -0.803778
H 3.408317 -1.046596 0.622559
H 0.642439 2.895017 -0.783720
H 0.912300 -1.200309 0.595964
H -5.585473 1.736891 -0.512666
H -5.408539 -2.412017 0.787596
H -3.037498 1.843288 -0.508863
H -2.859141 -2.287799 0.784914
H 7.246450 1.539817 0.973299
H 4.792579 -1.390096 -1.116493
H 9.139076 -0.089390 1.025328
H 6.658654 -3.032025 -0.992867
H 8.850021 -2.400088 0.068061
H -8.623214 -1.055649 -1.806715


