%chk=000152783.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152783

0 1
 S    5.509100      0.5870000     -0.1717000    
 O    6.827200      0.4830000     -0.7696000    
 O    4.719100       1.791300     -0.3344000    
 N  -0.9227000     -0.8367000      0.4691000    
 N    4.600800     -0.8091000     -0.6100000    
 N   -3.834600       2.167300      0.1357000    
 C   -1.924400      0.1558000      0.3515000    
 C   -3.259600     -0.1723000      7.9700001E-02
 C   0.4564000     -0.8300000      0.1993000    
 C    3.199800     -0.8158000     -0.3357000    
 C   -4.194300      0.8793000     -2.1299999E-02
 C    1.320000      -1.647500      0.9337000    
 C   0.9723000     -5.7000001E-03 -0.8042000    
 C    2.689100      -1.640300      0.6667000    
 C    2.341400      1.4000000E-03  -1.071400    
 C   -1.550700       1.482000      0.5138000    
 C   -3.670100      -1.505500     -8.9800000E-02
 C   -5.520600      0.5530000     -0.2914000    
 C   -2.536000       2.441400      0.3971000    
 C   -5.002800      -1.803200     -0.3591000    
 C   -5.928900     -0.7724000     -0.4599000    
 C    5.709300      0.2971000       1.572000    
 H   -1.239100      -1.683900      0.9310000    
 H   0.9356000      -2.293900       1.718800    
 H   0.3257000      0.6215000      -1.412100    
 H    3.348700      -2.280200       1.247100    
 H    2.721900      0.6356000      -1.867800    
 H  -0.5374000       1.786000      0.7507000    
 H   -2.974500      -2.337800     -2.7799999E-02
 H    5.066200      -1.708000     -0.4253000    
 H   -6.265500       1.342200     -0.3754000    
 H   -2.304500       3.494300      0.5204000    
 H   -5.316400      -2.834200     -0.4917000    
 H   -6.970800     -0.9956000     -0.6703000    
 H    6.340200       1.093100       1.973900    
 H    4.732400      0.3239000       2.057400    
 H    6.196700     -0.6686000       1.718800    


%chk=000152783-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152783

0 1
S 5.776345 0.498301 -0.032559
O 7.326418 0.025141 -0.158969
O 5.225823 1.856565 -0.730506
N -0.894149 -0.893563 0.262266
N 4.686404 -1.004149 -0.801747
N -3.847303 2.225208 0.209813
C -1.837406 0.146728 0.189609
C -3.243463 -0.198649 0.070382
C 0.496504 -0.860664 0.023905
C 3.308825 -0.968807 -0.479048
C -4.206697 0.884034 0.111076
C 1.302021 -1.880052 0.610871
C 1.119097 0.099683 -0.827557
C 2.686495 -1.920516 0.383228
C 2.497721 0.039951 -1.079450
C -1.496607 1.508748 0.284785
C -3.722841 -1.538772 -0.090502
C -5.603293 0.578747 0.036391
C -2.527930 2.492015 0.281293
C -5.093671 -1.806550 -0.166193
C -6.042578 -0.740839 -0.091455
C 5.345418 0.646323 1.846434
H -1.257093 -1.793025 0.583058
H 0.836854 -2.628209 1.264816
H 0.516049 0.855682 -1.336578
H 3.291597 -2.702825 0.858993
H 2.971225 0.753876 -1.759853
H -0.460922 1.828652 0.415819
H -3.021246 -2.375305 -0.198216
H 5.188319 -1.842613 -0.450156
H -6.299882 1.421571 0.077614
H -2.254640 3.551053 0.361914
H -5.442190 -2.836469 -0.298493
H -7.113719 -0.961873 -0.149435
H 5.851935 1.562756 2.179793
H 4.251856 0.726238 1.914234
H 5.745724 -0.253893 2.332221


