%chk=000092200.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092200

0 1
 S   -3.249400     -0.5186000      0.9660000    
 S    3.282600     -0.5874000     -0.9184000    
 S   -3.069200       2.388200       1.375400    
 S    3.212400       2.325000      -1.320800    
 N   -1.396400       1.020000     -0.3361000    
 N    1.426600       1.005000      0.3127000    
 N   -1.327000      -1.368700     -0.7551000    
 N    1.263700      -1.381700      0.7168000    
 C  -0.5464000       2.203200     -0.5225000    
 C   0.6077000       2.214200      0.4690000    
 C   -1.189200     -3.9400000E-02  -1.341100    
 C    1.143800     -5.0600000E-02   1.302900    
 C   -2.685000      -1.646100     -0.3209000    
 C    2.629200      -1.700900      0.3383000    
 C   -2.476100       1.024500      0.5680000    
 C    2.542900      0.9782000     -0.5455000    
 C   -2.047800      0.1897000      -2.588800    
 C    1.956200      0.1463000       2.586600    
 C   -2.742800      -3.073600      0.2248000    
 C    2.664300      -3.127400     -0.2114000    
 H  -0.1686000       2.218200      -1.551700    
 H   -1.130500       3.121000     -0.4128000    
 H    1.203600       3.118800      0.3244000    
 H   0.2370000       2.266800       1.499200    
 H  -0.1445000      1.8999999E-02  -1.666300    
 H   9.2000000E-02  3.9799999E-02   1.591500    
 H   -1.042900      -2.067800      -1.441700    
 H   0.9290000      -2.073600       1.387600    
 H   -3.386100      -1.593600      -1.160200    
 H    3.295800      -1.673800       1.206500    
 H   -1.919900     -0.6249000      -3.309700    
 H   -3.112900      0.2822000      -2.353000    
 H   -1.754500       1.119900      -3.088200    
 H    1.773400     -0.6671000       3.296800    
 H    3.032500      0.2063000       2.395600    
 H    1.671600       1.082900       3.079200    
 H   -3.758800      -3.340100      0.5388000    
 H   -2.448100      -3.794700     -0.5470000    
 H   -2.071500      -3.215800       1.080500    
 H    3.683500      -3.425300     -0.4839000    
 H    2.314600      -3.841500      0.5439000    
 H    2.025200      -3.245200      -1.095000    


%chk=000092200-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092200

0 1
S -2.353472 -1.598771 0.385003
S 2.309631 -1.641618 -0.352771
S -1.775730 0.732913 2.187823
S 1.757542 0.638452 -2.228556
N -1.358542 0.841800 -0.518054
N 1.343730 0.838285 0.472757
N -1.288060 -0.970515 -2.204783
N 1.248091 -0.921202 2.214469
C -0.737391 2.170723 -0.327865
C 0.741257 2.169336 0.240491
C -1.643286 0.417220 -1.966632
C 1.622008 0.453642 1.933855
C -2.087160 -1.981502 -1.601785
C 2.033336 -1.961130 1.643763
C -1.772782 0.125708 0.569384
C 1.747195 0.082676 -0.592054
C -3.106474 0.746475 -2.316624
C 3.089418 0.773924 2.274413
C -1.486940 -3.379679 -1.717468
C 1.411959 -3.346127 1.799916
H -0.731103 2.662768 -1.314747
H -1.367260 2.755298 0.366413
H 1.378729 2.722080 -0.472670
H 0.742888 2.692545 1.211137
H -0.949501 1.027296 -2.567395
H 0.936502 1.091002 2.515514
H -0.269429 -1.124300 -2.184829
H 0.227278 -1.060584 2.199074
H -3.129318 -1.941439 -1.952410
H 3.075331 -1.925469 1.995478
H -3.314514 0.449125 -3.358948
H -3.816321 0.233919 -1.644659
H -3.280113 1.831951 -2.220033
H 3.292737 0.507786 3.326091
H 3.792881 0.230231 1.620477
H 3.277970 1.853181 2.142599
H -2.101908 -4.118596 -1.176843
H -1.442100 -3.676853 -2.781750
H -0.463425 -3.402557 -1.302412
H 2.019845 -4.110895 1.287962
H 1.355367 -3.608004 2.872880
H 0.391130 -3.367695 1.378185


