%chk=000123692.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123692

0 1
 S    1.154100      0.4080000      -1.516700    
 N   -1.843600     -0.5768000     -7.1000000E-03
 C   -1.191900      0.7325000     -2.5800001E-02
 C   -1.732700       1.486000      -1.274600    
 C   -1.623400       1.527100       1.240000    
 C   -3.232000       1.792300      -1.217700    
 C   -3.119900       1.847500       1.295300    
 C   -3.593600       2.568700      4.1099999E-02
 C   -1.462400      -1.357700      -1.192400    
 C   -1.515500      -1.296700       1.231500    
 C   0.3383000      0.5445000     -3.1399999E-02
 C   -2.173900      -2.711400      -1.213400    
 C   -2.228900      -2.648400       1.289600    
 C   -1.907900      -3.497800      6.5200001E-02
 C    1.184300      0.4672000       1.042200    
 C    2.554600      0.2898000      0.6535000    
 C    2.683400      0.2397000     -0.7380000    
 C    3.726100      0.1655000       1.439100    
 C    3.938100      7.0900001E-02  -1.355900    
 C    4.972100     -2.0999999E-03  0.8292000    
 C    5.074600     -4.8799999E-02 -0.5538000    
 H   -1.506300       1.026300      -2.240100    
 H   -1.212700       2.455700      -1.325800    
 H   -1.093400       2.492600       1.219700    
 H   -1.310500       1.089500       2.192500    
 H   -3.811900      0.8632000      -1.264300    
 H   -3.514600       2.382200      -2.097600    
 H   -3.322400       2.476500       2.170000    
 H   -3.698000      0.9263000       1.433100    
 H   -3.138400       3.566000     -7.9999998E-04
 H   -4.678400       2.716500      8.6199999E-02
 H  -0.4032000      -1.621100      -1.210500    
 H   -1.732000     -0.8867000      -2.139000    
 H   -1.857200     -0.7773000       2.129200    
 H  -0.4467000      -1.503700       1.341600    
 H   -1.841000      -3.295100      -2.079500    
 H   -3.254300      -2.556700      -1.329100    
 H   -3.313400      -2.489700       1.349200    
 H   -1.935100      -3.186400       2.198300    
 H   -2.508500      -4.413900      7.5099997E-02
 H  -0.8545000      -3.802400      9.6299998E-02
 H   0.8704000      0.5304000       2.076400    
 H    3.661700      0.2000000       2.523900    
 H    4.027800      3.3300001E-02  -2.437800    
 H    5.863600     -9.6299998E-02   1.442800    
 H    6.047800     -0.1794000      -1.019100    


%chk=000123692-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123692

0 1
S 1.297362 0.180874 -1.581383
N -1.732140 -0.674455 0.000970
C -1.110025 0.710570 -0.014060
C -1.610751 1.532445 -1.245755
C -1.585566 1.495383 1.256267
C -3.142930 1.734313 -1.255713
C -3.117909 1.683527 1.287579
C -3.618308 2.439610 0.035522
C -1.753401 -1.435549 -1.277188
C -1.274321 -1.555138 1.111102
C 0.419482 0.633360 -0.023958
C -2.728375 -2.630655 -1.179635
C -2.229811 -2.754804 1.293070
C -2.343642 -3.568590 -0.014786
C 1.316150 0.769138 1.018525
C 2.706324 0.538390 0.674000
C 2.884496 0.203394 -0.706546
C 3.854936 0.605869 1.509444
C 4.154246 -0.059870 -1.257781
C 5.127848 0.344695 0.968155
C 5.279203 0.013802 -0.407113
H -1.268805 1.077379 -2.193770
H -1.112285 2.520429 -1.191766
H -1.087080 2.485035 1.240976
H -1.253541 0.993281 2.183103
H -3.649402 0.753928 -1.338361
H -3.428083 2.329260 -2.145422
H -3.402040 2.233115 2.206496
H -3.599479 0.688245 1.329499
H -3.225748 3.478183 0.051698
H -4.722976 2.512805 0.047853
H -0.737213 -1.818513 -1.545964
H -2.082776 -0.776447 -2.096090
H -1.236840 -0.974227 2.047357
H -0.240129 -1.937443 0.923445
H -2.723390 -3.179055 -2.141897
H -3.753443 -2.242050 -1.019625
H -3.229684 -2.376460 1.583421
H -1.858724 -3.392078 2.119495
H -3.085334 -4.382648 0.093850
H -1.366674 -4.046659 -0.235478
H 1.003858 1.040469 2.029846
H 3.742783 0.860488 2.569557
H 4.272052 -0.314118 -2.316275
H 6.013705 0.396240 1.610653
H 6.277080 -0.185666 -0.812717


