%chk=000020855.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020855

0 1
 S   -1.625000     -0.1433000      0.8781000    
 S   0.1019000       2.247400       1.176300    
 N   0.9750000     -0.1300000      7.7799998E-02
 C    2.323700      0.3942000     -0.1508000    
 C   0.8054000      -1.521900     -0.3504000    
 C  -4.6999998E-02  0.6448000      0.6611000    
 C    2.446500       1.009400      -1.534500    
 C    1.172100      -2.487600      0.7638000    
 C   -2.379700      0.2886000     -0.7079000    
 C   -3.773000     -0.3016000     -0.8134000    
 H    2.580300       1.141000      0.6059000    
 H    3.052100     -0.4166000     -3.5900000E-02
 H  -0.2151000      -1.718000     -0.6848000    
 H    1.442600      -1.706600      -1.223200    
 H    2.250200      0.2705000      -2.318000    
 H    1.738700       1.832600      -1.672600    
 H    3.457100       1.401400      -1.685600    
 H    2.215600      -2.364900       1.071200    
 H   0.5471000      -2.334900       1.649100    
 H    1.038800      -3.520700      0.4277000    
 H   -2.439300       1.377800     -0.7996000    
 H   -1.758900     -8.3700001E-02  -1.528600    
 H   -3.751700      -1.395200     -0.7545000    
 H   -4.431700      7.7500001E-02 -2.4599999E-02
 H   -4.220400     -3.1300001E-02  -1.775700    


%chk=000020855-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000020855

0 1
S -1.544650 -0.710354 -0.394638
S -0.216607 2.116463 -0.203485
N 1.130495 -0.264125 -0.272135
C 2.413501 0.481287 -0.145897
C 1.250340 -1.743606 -0.374156
C -0.064314 0.411818 -0.286088
C 2.982621 0.903440 -1.515830
C 1.244119 -2.442593 1.002468
C -2.956035 0.548153 -0.490750
C -4.281262 -0.217553 -0.614588
H 2.225874 1.374886 0.473589
H 3.123445 -0.176447 0.389943
H 0.429777 -2.128593 -1.005280
H 2.194606 -1.956470 -0.908648
H 3.155088 0.029536 -2.170465
H 2.281677 1.590792 -2.018487
H 3.946741 1.426530 -1.379614
H 2.066304 -2.072899 1.641552
H 0.289469 -2.264857 1.525824
H 1.373109 -3.532968 0.874550
H -2.901469 1.163982 0.420356
H -2.753590 1.195763 -1.358223
H -4.311773 -0.837326 -1.528187
H -4.457795 -0.873286 0.256473
H -5.114371 0.507324 -0.667382


