%chk=000069532.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069532

0 1
 S   0.7822000      0.3011000      0.6605000    
 S  -0.7795000      0.3016000     -0.6748000    
 O    5.398900       1.263200     -0.2686000    
 O   -5.399000       1.262100      0.2814000    
 N    3.573600     -6.2600002E-02 -0.8161000    
 N   -3.574600     -7.0600003E-02  0.8117000    
 N    7.648200      -2.179500      0.7737000    
 N   -7.650800      -2.174300     -0.7759000    
 C    2.702100       1.012900      -1.205400    
 C   -2.698700       1.006500       1.206600    
 C    5.579500      -1.139300     -2.3399999E-02
 C   -5.579600      -1.138700      2.0700000E-02
 C    1.874400       1.556800     -4.8999999E-02
 C   -1.875400       1.558600      5.0799999E-02
 C    4.872500      0.1585000     -0.3724000    
 C   -4.871800      0.1569000      0.3759000    
 C    7.005700     -0.9082000      0.4647000    
 C   -7.007700     -0.9048000     -0.4605000    
 H    3.309700       1.824700      -1.621600    
 H    2.064700      0.6427000      -2.015600    
 H   -3.305700       1.814600       1.630800    
 H   -2.058400      0.6295000       2.011100    
 H    5.583500      -1.775200     -0.9175000    
 H    4.991300      -1.649100      0.7498000    
 H   -4.994400      -1.643200     -0.7584000    
 H   -5.580300      -1.780900      0.9102000    
 H    2.541800       1.893500      0.7521000    
 H    1.292800       2.429400     -0.3640000    
 H   -2.544900       1.898500     -0.7471000    
 H   -1.291200       2.428500      0.3684000    
 H    3.214800      -1.012000     -0.8609000    
 H   -3.215500      -1.020200      0.8488000    
 H    7.003800     -0.2730000       1.357800    
 H    7.589100     -0.3887000     -0.3035000    
 H   -7.009400     -0.2636000      -1.349200    
 H   -7.588400     -0.3909000      0.3135000    
 H    7.130000      -2.656200       1.510700    
 H    8.580400      -2.005300       1.146900    
 H   -7.135200      -2.645700      -1.518000    
 H   -8.584500      -1.997900      -1.144400    


%chk=000069532-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000069532

0 1
S 0.718851 0.355084 0.886402
S -0.719147 0.357501 -0.882013
O 5.644767 1.195398 -0.735806
O -5.644626 1.195637 0.734535
N 3.604727 0.083865 -0.599103
N -3.605477 0.081900 0.602869
N 7.664151 -2.355910 0.659294
N -7.664317 -2.352142 -0.669107
C 2.794774 1.273188 -0.878845
C -2.795113 1.270118 0.886050
C 5.674272 -1.224713 -0.288500
C -5.675516 -1.224012 0.284577
C 1.941280 1.703995 0.323002
C -1.941718 1.704549 -0.314619
C 4.992760 0.120865 -0.550159
C -4.993323 0.120537 0.549721
C 6.939334 -1.073142 0.584366
C -6.938598 -1.070098 -0.590722
H 3.503952 2.081688 -1.135510
H 2.136123 1.096013 -1.751091
H -3.503945 2.078099 1.145244
H -2.136351 1.089935 1.757568
H 5.993103 -1.655882 -1.257014
H 4.966917 -1.945152 0.169643
H -4.967818 -1.944394 -0.173130
H -5.996722 -1.656366 1.251781
H 2.565218 1.880828 1.217717
H 1.357811 2.612386 0.099535
H -2.565787 1.883916 -1.208737
H -1.358409 2.612407 -0.088564
H 3.114212 -0.790630 -0.399945
H -3.115399 -0.792802 0.403637
H 6.648691 -0.653428 1.576885
H 7.589910 -0.323102 0.102960
H -6.645523 -0.649152 -1.581999
H -7.589582 -0.320221 -0.109612
H 7.183296 -3.086003 1.193746
H 8.648846 -2.272155 0.925248
H -7.183135 -3.081743 -1.203926
H -8.648491 -2.267160 -0.936575


