%chk=000132357.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132357

0 1
 S   0.7898000     -0.6578000     -0.1491000    
 S  -0.7920000      0.6521000     -9.1700003E-02
 N    3.456800       1.758500       1.801000    
 N   -3.461800      -1.898300       1.652100    
 C    2.698500       1.234200      0.6585000    
 C   -2.701800      -1.286600      0.5550000    
 C    3.660000      0.9570000     -0.5177000    
 C   -3.662600     -0.9118000     -0.5944000    
 C    4.709300     -0.1316000     -0.2553000    
 C   -4.707400      0.1564000     -0.2445000    
 C    1.874800      2.9700000E-02   1.139700    
 C   -1.873000     -0.1282000       1.131100    
 C    5.692600     -0.3116000      -1.416200    
 C   -5.690300      0.4333000      -1.386400    
 C    6.688600      -1.440800      -1.201400    
 C   -6.681600       1.545500      -1.080700    
 H    2.013200       2.030900      0.3431000    
 H   -2.020200      -2.058400      0.1759000    
 H    3.083800      0.6911000      -1.411900    
 H    4.180500       1.890500     -0.7720000    
 H   -3.085800     -0.5774000      -1.464900    
 H   -4.187000      -1.819700     -0.9225000    
 H    4.206800      -1.088800     -7.5999998E-02
 H    5.278400      0.1048000      0.6512000    
 H   -4.201000       1.094000      1.1100000E-02
 H   -5.277000     -0.1501000      0.6404000    
 H    2.537300     -0.7780000       1.470200    
 H    1.264800      0.2924000       2.012400    
 H   -2.533300      0.6510000       1.527700    
 H   -1.265600     -0.4641000       1.980300    
 H    6.243200      0.6235000      -1.573200    
 H    5.132500     -0.5091000      -2.338100    
 H   -6.244800     -0.4839000      -1.617800    
 H   -5.129700      0.7021000      -2.289600    
 H    3.957200       2.601700       1.522500    
 H    2.814200       2.037400       2.541400    
 H   -3.966000      -2.714000       1.306900    
 H   -2.819900      -2.238800       2.366900    
 H    7.292500      -1.262500     -0.3061000    
 H    6.172700      -2.398900      -1.082600    
 H    7.364100      -1.520900      -2.058800    
 H   -7.286000       1.298200     -0.2023000    
 H   -6.161800       2.488800     -0.8854000    
 H   -7.357000       1.697100      -1.928400    


%chk=000132357-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132357

0 1
S 0.825289 -0.800563 -0.130883
S -0.817694 0.770852 -0.081633
N 3.559586 1.668901 1.829232
N -3.572360 -1.813603 1.692060
C 2.776729 1.167514 0.672898
C -2.786990 -1.230793 0.576634
C 3.723526 0.890938 -0.521955
C -3.732525 -0.853347 -0.591093
C 4.808364 -0.183489 -0.281947
C -4.804725 0.213340 -0.268141
C 2.012173 -0.081163 1.160497
C -2.010000 -0.030121 1.155982
C 5.846829 -0.238688 -1.426560
C -5.841977 0.369199 -1.403752
C 6.906477 -1.342805 -1.222826
C -6.890192 1.464359 -1.110601
H 2.011671 1.902665 0.322730
H -2.028917 -1.943562 0.169095
H 3.102019 0.605927 -1.392641
H 4.216100 1.850502 -0.790952
H -3.109269 -0.510134 -1.439462
H -4.236722 -1.783794 -0.931423
H 4.334845 -1.182064 -0.188167
H 5.318674 0.014289 0.680783
H -4.319106 1.195874 -0.098124
H -5.318146 -0.051001 0.676861
H 2.706417 -0.904440 1.404387
H 1.413019 0.146587 2.059575
H -2.696478 0.778929 1.461134
H -1.412697 -0.330110 2.034816
H 6.349819 0.747083 -1.510195
H 5.322229 -0.400981 -2.390662
H -6.354543 -0.601700 -1.565132
H -5.315911 0.603281 -2.352151
H 4.288537 2.343093 1.573915
H 2.987597 2.002321 2.612252
H -4.311135 -2.455538 1.386712
H -3.002021 -2.216757 2.442839
H 7.460399 -1.189889 -0.277309
H 6.432318 -2.341384 -1.174838
H 7.641893 -1.356985 -2.048438
H -7.447904 1.239997 -0.181586
H -6.405270 2.450212 -0.978814
H -7.623928 1.555946 -1.932715


