%chk=000115642.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115642

2 1
 S    0.000000     -0.7078000      9.9999997E-05
 N   -1.374200      0.4108000      0.2380000    
 N    1.374200      0.4108000     -0.2380000    
 C   -2.690300     -0.3659000      0.5369000    
 C    2.690300     -0.3660000     -0.5369000    
 C   -1.462400       1.257300      -1.054500    
 C    1.462400       1.257400       1.054300    
 C   -3.397800     -0.7235000     -0.7727000    
 C    3.397800     -0.7235000      0.7728000    
 C   -2.891400       1.719100      -1.290500    
 C    2.891400       1.719200       1.290300    
 C   -3.816900      0.5304000      -1.542100    
 C    3.816900      0.5306000       1.542100    
 C   -1.008800       1.302300       1.423900    
 C    1.008700       1.302200      -1.423900    
 C   -2.522800      -1.581100       1.453200    
 C    2.522800      -1.581200      -1.453100    
 C   -3.863400      -2.195400       1.789000    
 C    3.863400      -2.195600      -1.788800    
 H   -3.346300      0.3461000       1.056200    
 H    3.346200      0.3460000      -1.056200    
 H   -1.230700      0.6489000      -1.929600    
 H  -0.9831000       2.214900     -0.9093000    
 H    1.230700      0.6491000       1.929600    
 H   0.9830000       2.215000      0.9090000    
 H   -4.303100      -1.316200     -0.6135000    
 H   -2.740100      -1.338400      -1.400000    
 H    4.303100      -1.316200      0.6137000    
 H    2.740100      -1.338300       1.400200    
 H   -2.936700       2.399700      -2.149000    
 H   -3.252000       2.288700     -0.4244000    
 H    2.936600       2.400000       2.148800    
 H    3.252000       2.288800      0.4241000    
 H   -4.839200      0.8160000      -1.265800    
 H   -3.842600      0.2953000      -2.613100    
 H    4.839200      0.8161000       1.265600    
 H    3.842600      0.2956000       2.613000    
 H  -0.5746000      0.7510000       2.258600    
 H  -0.7153000       2.309300       1.137500    
 H   -1.979300       1.572200       1.870500    
 H   0.7153000       2.309200      -1.137600    
 H    1.979200       1.572100      -1.870500    
 H   0.5746000      0.7508000      -2.258600    
 H   -2.031100      -1.279000       2.385100    
 H   -1.912300      -2.366300      0.9952000    
 H    2.031200      -1.279000      -2.385200    
 H    1.912300      -2.366300     -0.9952000    
 H   -4.586600      -1.441600       2.116100    
 H   -4.287500      -2.752100      0.9486000    
 H   -3.743800      -2.913500       2.607900    
 H    4.586800      -1.441800      -2.115800    
 H    4.287500      -2.752300     -0.9483000    
 H    3.743900      -2.913800      -2.607700    


%chk=000115642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115642

2 1
S -0.000033 -0.489871 -0.000220
N -1.606282 0.621511 0.337624
N 1.606223 0.621575 -0.337851
C -2.798653 -0.477172 0.350025
C 2.798722 -0.476995 -0.349949
C -1.832030 1.658883 -0.791345
C 1.831647 1.659051 0.791068
C -3.351719 -0.620917 -1.074316
C 3.351348 -0.620769 1.074552
C -3.333074 1.937802 -0.989322
C 3.332644 1.937950 0.989463
C -4.049755 0.681421 -1.555624
C 4.049171 0.681602 1.556059
C -1.538789 1.292334 1.699884
C 1.538921 1.292300 -1.700168
C -2.387904 -1.798553 1.041663
C 2.388406 -1.798370 -1.041858
C -3.640733 -2.609753 1.468012
C 3.641480 -2.609351 -1.467896
H -3.542978 0.035982 0.992606
H 3.543203 0.036297 -0.992237
H -1.416687 1.232180 -1.718029
H -1.271122 2.566543 -0.507755
H 1.415971 1.232472 1.717668
H 1.270867 2.566691 0.507174
H -4.070601 -1.458118 -1.069802
H -2.541838 -0.930728 -1.763927
H 4.070284 -1.457921 1.070240
H 2.541268 -0.930641 1.763902
H -3.413715 2.787628 -1.691756
H -3.796867 2.288024 -0.048711
H 3.413089 2.787838 1.691847
H 3.796715 2.288083 0.048957
H -5.106098 0.686646 -1.236865
H -4.053962 0.707810 -2.658803
H 5.105606 0.686836 1.237609
H 4.053053 0.708025 2.659239
H -1.439305 0.531192 2.486818
H -0.698085 1.997239 1.741083
H -2.477423 1.852597 1.847024
H 0.698136 1.997097 -1.741559
H 2.477510 1.852678 -1.847167
H 1.439678 0.531100 -2.487075
H -1.786261 -1.603353 1.950172
H -1.782454 -2.426870 0.356326
H 1.787043 -1.603151 -1.950550
H 1.782841 -2.426879 -0.356791
H -4.276994 -2.028900 2.160494
H -4.254873 -2.918053 0.605231
H -3.327899 -3.527675 1.992167
H 4.277924 -2.028290 -2.160038
H 4.255342 -2.917750 -0.604952
H 3.328943 -3.527207 -1.992344


