%chk=000054962.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054962

0 1
 S    0.000000       2.178600      9.9999997E-05
 N    1.084400     -0.3357000      0.3340000    
 N   -1.084300     -0.3357000     -0.3341000    
 C   0.7488000      -1.728700      0.1206000    
 C  -0.7488000      -1.728600     -0.1205000    
 C    0.000000      0.5071000       0.000000    
 C    2.439800      3.3300001E-02  0.7105000    
 C   -2.439900      3.3399999E-02 -0.7106000    
 C    3.362700      0.1617000     -0.4954000    
 C   -3.362700      0.1617000      0.4954000    
 C    4.788900      0.5265000     -0.1086000    
 C   -4.788800      0.5264000      0.1086000    
 H    1.025800      -2.329400      0.9919000    
 H    1.292700      -2.088300     -0.7588000    
 H   -1.025900      -2.329500     -0.9918000    
 H   -1.292700      -2.088100      0.7589000    
 H    2.816600     -0.7212000       1.410500    
 H    2.409300      0.9863000       1.248600    
 H   -2.816600     -0.7209000      -1.410700    
 H   -2.409400      0.9866000      -1.248600    
 H    3.379500     -0.7826000      -1.052500    
 H    2.974000      0.9202000      -1.185200    
 H   -3.379400     -0.7826000       1.052400    
 H   -2.974100      0.9202000       1.185200    
 H    4.817500       1.487400      0.4148000    
 H    5.222800     -0.2356000      0.5465000    
 H    5.416200      0.6058000      -1.001800    
 H   -5.222700     -0.2356000     -0.5465000    
 H   -5.416300      0.6057000       1.001800    
 H   -4.817500       1.487300     -0.4148000    


%chk=000054962-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054962

0 1
S 0.000481 2.105077 0.000626
N 1.054269 -0.433702 0.387470
N -1.054004 -0.433437 -0.385858
C 0.770407 -1.858693 0.103878
C -0.770447 -1.858558 -0.102721
C -0.000109 0.385263 0.001708
C 2.398433 0.055419 0.706564
C -2.397821 0.055895 -0.706105
C 3.348009 0.125747 -0.515305
C -3.348613 0.125405 0.514848
C 4.743238 0.651151 -0.116519
C -4.743435 0.651057 0.114974
H 1.082248 -2.501405 0.946401
H 1.302903 -2.196454 -0.809034
H -1.082157 -2.500906 -0.945574
H -1.303213 -2.196580 0.809937
H 2.832671 -0.597764 1.490343
H 2.275143 1.069771 1.130133
H -2.831274 -0.596754 -1.490767
H -2.274124 1.070537 -1.128853
H 3.446072 -0.876381 -0.979390
H 2.891718 0.793920 -1.269611
H -3.447135 -0.877034 0.978165
H -2.893083 0.793084 1.270051
H 4.673501 1.666746 0.315353
H 5.221561 -0.004815 0.635928
H 5.414260 0.703636 -0.992659
H -5.220980 -0.004411 -0.638404
H -5.415350 0.702944 0.990464
H -4.673269 1.666943 -0.316141


