%chk=000095768.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095768

0 1
 S   -1.456000      0.1807000       1.546200    
 S    1.358100     -0.1206000      -1.472600    
 N   -1.237800      0.9136000     -0.9505000    
 N    1.140100     -0.8532000       1.024300    
 N   -6.322500      -2.464000      9.1799997E-02
 N    6.592200       2.245100     -0.2559000    
 C   -3.377500       1.552100      0.1138000    
 C    3.279100      -1.493000     -4.0399998E-02
 C   -4.484900      0.4836000      0.3771000    
 C    4.435600     -0.4856000     -0.4514000    
 C   -1.969300      0.9034000      9.8800004E-02
 C    1.935300     -0.8724000     -2.5800001E-02
 C   -3.517600       2.686700       1.155200    
 C   -3.644400       2.197300      -1.270300    
 C    3.738000      -2.158700       1.312000    
 C    3.349900      -2.672600      -1.080500    
 C  -3.8000001E-03 -0.2046000      0.6768000    
 C  -9.3900003E-02  0.2650000     -0.6030000    
 C   -4.510200     -0.6906000     -0.6110000    
 C    4.599400      0.7043000      0.5041000    
 C   -5.523500      -1.681600     -0.2174000    
 C    5.713700       1.565100      7.8699999E-02
 H   -5.467900      0.9761000      0.3586000    
 H   -4.383600      8.8900000E-02   1.397700    
 H    4.266800     -0.1106000      -1.469800    
 H    5.387600      -1.034000     -0.4997000    
 H   -2.733500       3.441300       1.022600    
 H   -4.487700       3.189400       1.068000    
 H   -3.439400       2.309400       2.180600    
 H   -3.524800       1.486800      -2.095500    
 H   -4.660500       2.604600      -1.328500    
 H   -2.948500       3.024100      -1.459200    
 H    3.081300      -2.999800       1.564400    
 H    4.764700      -2.536000       1.253800    
 H    3.675300      -1.450600       2.144700    
 H    4.320800      -3.180400      -1.042400    
 H    2.571200      -3.416800     -0.8759000    
 H    3.210000      -2.319000      -2.107900    
 H   -3.535200      -1.186300     -0.6561000    
 H   -4.741900     -0.3362000      -1.620600    
 H    4.800500      0.3590000       1.522700    
 H    3.679000       1.296700      0.5379000    


%chk=000095768-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000095768

0 1
S -1.206498 0.569627 1.677449
S 1.198876 -0.559370 -1.683264
N -1.340228 0.688728 -1.025934
N 1.332429 -0.678451 1.020118
N -6.277813 -2.517310 0.155896
N 6.268802 2.527713 -0.158006
C -3.428486 1.637892 0.064312
C 3.420462 -1.627894 -0.070100
C -4.484230 0.530093 0.417109
C 4.476448 -0.519920 -0.421413
C -2.041439 1.017911 0.052165
C 2.033439 -1.007803 -0.058167
C -3.515630 2.742981 1.155692
C -3.722302 2.265030 -1.325389
C 3.713577 -2.255926 1.319315
C 3.508112 -2.732203 -1.162183
C 0.136975 -0.080588 0.679091
C -0.144705 0.091221 -0.684915
C -4.528045 -0.650316 -0.591739
C 4.520687 0.659006 0.589162
C -5.492422 -1.685560 -0.184260
C 5.484250 1.695223 0.182258
H -5.479786 1.010787 0.461784
H -4.268073 0.133361 1.426989
H 4.260421 -0.121709 -1.430742
H 5.471889 -1.000811 -0.466768
H -2.765616 3.533116 0.977566
H -4.518660 3.206062 1.135695
H -3.352726 2.334994 2.170459
H -3.561662 1.548089 -2.146115
H -4.766963 2.625162 -1.355069
H -3.051945 3.122154 -1.509374
H 3.042455 -3.112538 1.502844
H 4.757940 -2.616915 1.348891
H 3.553476 -1.539172 2.140312
H 4.511181 -3.195250 -1.142313
H 2.758178 -3.522626 -0.984916
H 3.345516 -2.323625 -2.176778
H -3.527146 -1.112530 -0.685131
H -4.807307 -0.289565 -1.598810
H 4.801083 0.296880 1.595435
H 3.519683 1.120652 0.684243


