%chk=000007232.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000007232

0 1
 S   0.7165000       1.633100     -0.3277000    
 S   -2.281500       2.079700     -0.2377000    
 N    1.512500      0.1881000     -0.2098000    
 N   -1.172700     -0.2406000     -4.0700000E-02
 C    2.980200      0.1406000     -0.4251000    
 C    3.678300      0.8774000      0.7187000    
 C    3.427600      -1.319400     -0.5052000    
 C    5.196900      0.7629000      0.6119000    
 C    4.946400      -1.432800     -0.6112000    
 C    5.646600     -0.6931000      0.5255000    
 C  -0.9414000       1.033500     -0.1875000    
 C   -3.320200      0.7170000     -4.4599999E-02
 C   -2.542700     -0.4417000      4.3600000E-02
 C   -4.722200      0.6763000      2.3900000E-02
 C   -3.193800      -1.683700      0.2061000    
 C   -5.341400     -0.5656000      0.1849000    
 C   -4.589100      -1.731600      0.2750000    
 H    3.222300      0.6271000      -1.379700    
 H    3.361400      0.4665000       1.686800    
 H    3.416600       1.941900      0.7249000    
 H    2.965500      -1.809800      -1.370900    
 H    3.093500      -1.869000      0.3850000    
 H    5.665300       1.242000       1.479100    
 H    5.541900       1.304400     -0.2776000    
 H    5.276500      -1.020400      -1.572600    
 H    5.239200      -2.488700     -0.5995000    
 H    6.731900     -0.7359000      0.3801000    
 H    5.431300      -1.197800       1.475500    
 H    1.291400     -0.2710000      0.6741000    
 H   -5.316000       1.582600     -4.5699999E-02
 H   -2.615900      -2.600700      0.2776000    
 H   -6.425600     -0.6194000      0.2402000    
 H   -5.088200      -2.688600      0.4001000    


%chk=000007232-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000007232

0 1
S 0.829909 1.283075 2.513336
S -1.989276 2.047892 1.251336
N 1.970226 -0.073720 2.215447
N -0.779580 -0.346586 0.903843
C 2.592401 -0.150704 0.857160
C 3.551273 1.034344 0.623164
C 3.354943 -1.496350 0.787197
C 4.270974 0.895833 -0.740206
C 4.082536 -1.645428 -0.571707
C 5.027996 -0.450388 -0.839529
C -0.611321 0.817448 1.486807
C -2.817915 0.759992 0.270190
C -2.004626 -0.419741 0.204368
C -4.070506 0.828624 -0.368307
C -2.462076 -1.544775 -0.520553
C -4.511611 -0.305424 -1.088913
C -3.714590 -1.478931 -1.163312
H 1.811355 -0.151951 0.063223
H 4.293374 1.049279 1.446008
H 2.990818 1.987566 0.670014
H 2.650318 -2.339971 0.935058
H 4.091488 -1.527479 1.614722
H 4.970636 1.741582 -0.881695
H 3.524673 0.957515 -1.559258
H 3.330271 -1.707033 -1.384738
H 4.649074 -2.596305 -0.586510
H 5.496901 -0.553740 -1.837225
H 5.850017 -0.460851 -0.094149
H 1.503755 -0.958672 2.475333
H -4.690150 1.728846 -0.315158
H -1.838360 -2.442430 -0.566076
H -5.482178 -0.274251 -1.595323
H -4.079650 -2.343965 -1.727044


