%chk=000004926.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004926

0 1
 S   -1.185600       1.856700       1.452600    
 N  -0.2405000     -0.1696000     -0.7072000    
 N    2.552100      -1.905400      0.6090000    
 C   0.3496000      -1.334800      -1.378500    
 C   0.3952000      -2.536600     -0.4355000    
 C    1.171600      -2.298600      0.8634000    
 C   0.5856000      0.9689000     -0.5288000    
 C   -1.610400     -0.2466000     -0.3494000    
 C   0.2503000       1.970400      0.4037000    
 C   -2.163100      0.6344000      0.6013000    
 C    1.754300       1.172200      -1.294900    
 C   -2.488500      -1.176300     -0.9480000    
 C    1.068700       3.101800      0.5706000    
 C   -3.524100      0.5589000      0.9468000    
 C    3.272800      -2.973600     -8.6199999E-02
 C    3.231200      -1.566800       1.861000    
 C    2.561500       2.300900      -1.128600    
 C   -3.841500      -1.243800     -0.6046000    
 C    2.219900       3.265300     -0.1927000    
 C   -4.359200     -0.3774000      0.3460000    
 H  -0.1989000      -1.577600      -2.296400    
 H    1.372400      -1.202200      -1.729300    
 H   0.7968000      -3.400000     -0.9790000    
 H  -0.6152000      -2.850300     -0.1514000    
 H    1.129800      -3.211100       1.473300    
 H   0.6614000      -1.520600       1.444400    
 H    2.062300      0.5056000      -2.093000    
 H   -2.158100      -1.870700      -1.714800    
 H   0.8162000       3.870300       1.298500    
 H   -3.949200       1.231200       1.689300    
 H    2.915500      -3.112100      -1.110900    
 H    3.213500      -3.930900      0.4445000    
 H    4.333400      -2.712600     -0.1861000    
 H    4.253400      -1.224500       1.664600    
 H    3.277200      -2.417900       2.550100    
 H    2.717700     -0.7404000       2.365300    
 H    3.448300       2.428600      -1.742600    
 H   -4.487200      -1.972400      -1.086100    
 H    2.842900       4.144500     -6.0300000E-02
 H   -5.409300     -0.4263000      0.6172000    


%chk=000004926-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000004926

0 1
S -0.939084 1.528451 1.830210
N -0.132809 -0.157416 -0.584369
N 2.660523 -2.322580 0.622642
C 0.507486 -1.306068 -1.270994
C 0.398591 -2.613865 -0.453390
C 1.210495 -2.532857 0.858798
C 0.555054 1.093678 -0.513830
C -1.531625 -0.206217 -0.302475
C 0.251773 2.022822 0.520926
C -2.082358 0.575912 0.751444
C 1.537789 1.464615 -1.472526
C -2.419609 -1.015929 -1.063111
C 0.893932 3.273994 0.595288
C -3.464373 0.573376 1.021574
C 3.358740 -3.547695 0.185504
C 3.338482 -1.681883 1.768685
C 2.212130 2.700788 -1.375014
C -3.799814 -1.048899 -0.769026
C 1.894292 3.613602 -0.344711
C -4.331800 -0.253230 0.270043
H 0.106375 -1.445517 -2.297319
H 1.584463 -1.084924 -1.350658
H 0.763120 -3.445902 -1.087627
H -0.654701 -2.842727 -0.206703
H 1.021081 -3.453332 1.467442
H 0.832562 -1.674774 1.445073
H 1.768321 0.791792 -2.303386
H -2.031712 -1.617696 -1.890189
H 0.623260 3.970653 1.395821
H -3.855866 1.202514 1.827954
H 2.892361 -3.953710 -0.729190
H 3.351800 -4.355531 0.961860
H 4.411590 -3.311192 -0.052427
H 4.391022 -1.469930 1.506357
H 3.335853 -2.309989 2.695472
H 2.844815 -0.722229 2.001482
H 2.975188 2.955891 -2.118568
H -4.460252 -1.689631 -1.363693
H 2.408960 4.577282 -0.274179
H -5.403258 -0.271051 0.494111


