%chk=000146352.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146352

0 1
 S   -1.361800     -0.5704000      0.5444000    
 O   -4.856100      -1.914800      0.9359000    
 O   -4.012700      -2.742000     -0.9993000    
 O   -4.954600       2.319100      -1.096500    
 N   -4.420800      0.5796000      0.3562000    
 N    1.323900     -0.4363000      0.7583000    
 N    7.899900      0.5747000     -0.6036000    
 C   -3.912800     -0.3487000     -0.6227000    
 C   -2.417500     -0.1473000     -0.8811000    
 C   0.2626000     -0.2442000     -0.2035000    
 C   -4.249600      -1.787700     -0.2685000    
 C    2.665200     -0.2294000      0.4804000    
 C   -4.900100       1.839500      3.3000000E-02
 C    3.082300      0.1933000     -0.7959000    
 C    3.647600     -0.4374000       1.466700    
 C    4.433100      0.4003000      -1.075700    
 C    4.998400     -0.2303000       1.187000    
 C   -5.392700       2.592000       1.239900    
 C    5.391100      0.1886000     -8.4299996E-02
 C    6.774700      0.4015000     -0.3706000    
 H   -4.451100     -0.1439000      -1.557400    
 H   -2.107300     -0.7803000      -1.719900    
 H   -2.222700      0.8955000      -1.154700    
 H   -4.412600      0.2932000       1.331200    
 H   0.3891000     -0.9266000      -1.050300    
 H   0.2626000      0.7897000     -0.5637000    
 H    1.070000     -0.7421000       1.690700    
 H    2.369700      0.3688000      -1.597500    
 H    3.358800     -0.7644000       2.463200    
 H    4.724100      0.7267000      -2.071300    
 H    5.733400     -0.3995000       1.970200    
 H   -5.584500       3.634500      0.9714000    
 H   -6.319000       2.136800       1.600900    
 H   -4.640500       2.567500       2.033700    
 H   -5.070600      -2.849600       1.141800    


%chk=000146352-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146352

0 1
S -1.447003 0.122573 2.169164
O -3.539373 -2.066403 -0.527512
O -1.243673 -1.893947 -0.776157
O -3.894154 2.506431 -1.181701
N -3.911211 0.505057 -0.017629
N 1.380058 -0.389288 2.114622
N 5.724489 0.564403 -3.152810
C -2.562670 0.167497 -0.477156
C -1.451005 0.800103 0.398043
C 0.104462 -1.048864 2.137642
C -2.352441 -1.338301 -0.605829
C 2.216607 -0.197595 1.005071
C -4.506609 1.690013 -0.424924
C 1.952643 -0.762184 -0.279432
C 3.406615 0.573257 1.181449
C 2.856360 -0.562260 -1.335665
C 4.302134 0.771122 0.121991
C -5.917518 1.938684 0.089812
C 4.043623 0.202987 -1.158444
C 4.959545 0.400407 -2.245833
H -2.453040 0.614146 -1.490881
H -0.456778 0.631256 -0.042512
H -1.632353 1.883553 0.465235
H -4.415000 -0.167676 0.560523
H -0.034679 -1.607411 3.078034
H -0.015247 -1.726255 1.282915
H 1.637425 0.121260 2.961398
H 1.047109 -1.346332 -0.467470
H 3.623869 1.014632 2.162021
H 2.642629 -1.000584 -2.315858
H 5.208262 1.365622 0.275703
H -5.931237 2.877731 0.669328
H -6.594379 2.077214 -0.770678
H -6.304392 1.122202 0.723022
H -3.343570 -3.036648 -0.637083


