%chk=000013310.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013310

0 1
 S   -2.666200      -1.058500       1.661600    
 N    4.460900       1.571500     -2.1900000E-02
 C  -0.3408000      0.3637000     -0.5416000    
 C   0.6849000       1.188600      0.2543000    
 C  -6.9300003E-02  -1.130500     -0.4757000    
 C    2.094500      0.9352000     -0.2620000    
 C   -1.768100      0.8639000     -0.3190000    
 C  -0.2725000      -1.901700      0.6799000    
 C    3.128500       1.781600      0.4731000    
 C   -2.748500      0.3539000      0.5573000    
 C  -0.8976000      -1.316600       1.907800    
 C   0.4632000      -1.764700      -1.617800    
 C   -2.108800       2.008800      -1.089800    
 C   5.3500000E-02  -3.271400      0.6701000    
 C   -4.016600      0.9835000      0.6022000    
 C   0.7832000      -3.122500      -1.615200    
 C   -3.360500       2.617100      -1.023000    
 C   0.5800000      -3.876800     -0.4683000    
 C   -4.320000       2.099500     -0.1745000    
 C    4.900500      0.1834000      0.1927000    
 C    5.419800       2.491900      0.6097000    
 H  -0.1493000      0.6166000      -1.596900    
 H   0.4639000       2.258700      0.1433000    
 H   0.6462000      0.9945000       1.327700    
 H    2.327300     -0.1238000     -0.1224000    
 H    2.144600       1.147600      -1.337600    
 H    3.068100       1.581200       1.551500    
 H    2.851500       2.835500      0.3382000    
 H  -0.7935000      -2.016400       2.745600    
 H  -0.4134000     -0.4037000       2.250200    
 H   0.6440000      -1.197600      -2.528700    
 H   -1.375400       2.445700      -1.767200    
 H  -0.1122000      -3.880900       1.555700    
 H   -4.800800      0.6082000       1.259800    
 H    1.193200      -3.585800      -2.507600    
 H   -3.577600       3.488700      -1.632600    
 H   0.8253000      -4.934400     -0.4591000    
 H   -5.301800       2.558300     -0.1107000    
 H    4.358500     -0.5175000     -0.4490000    
 H    4.794200     -0.1284000       1.238000    
 H    5.955000      7.0699997E-02 -8.6599998E-02
 H    6.418500       2.363400      0.1780000    
 H    5.484900       2.337000       1.692800    
 H    5.130300       3.532400      0.4249000    


%chk=000013310-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013310

0 1
S -1.712351 -0.122449 2.293881
N 4.642918 1.545078 0.345981
C -0.248316 0.492542 -0.752395
C 0.771301 1.338657 0.074137
C -0.113537 -1.039106 -0.709394
C 2.240847 0.920416 -0.148958
C -1.698647 0.907209 -0.462901
C -0.156064 -1.805890 0.494270
C 3.215255 1.812439 0.646456
C -2.384806 0.650210 0.758236
C -0.158362 -1.148424 1.848441
C -0.039884 -1.732169 -1.943983
C -2.415283 1.578698 -1.489898
C -0.147907 -3.222224 0.421943
C -3.737063 1.054677 0.916144
C -0.013949 -3.142369 -2.008711
C -3.750724 2.002024 -1.330529
C -0.075205 -3.895816 -0.816145
C -4.416544 1.735934 -0.112963
C 5.088148 0.204320 0.776507
C 5.521541 2.606047 0.880541
H -0.057996 0.769745 -1.808137
H 0.637250 2.392911 -0.242808
H 0.520518 1.323665 1.150723
H 2.365970 -0.141951 0.135138
H 2.498792 0.992920 -1.224098
H 2.998350 1.705129 1.745075
H 3.015847 2.871007 0.387015
H -0.149900 -1.904853 2.650572
H 0.709826 -0.486919 1.988183
H -0.009803 -1.151516 -2.874166
H -1.898251 1.773068 -2.437962
H -0.193816 -3.801284 1.352425
H -4.256213 0.827064 1.854286
H 0.047433 -3.645969 -2.979759
H -4.265616 2.522760 -2.144853
H -0.065274 -4.990747 -0.848026
H -5.457839 2.042683 0.034042
H 4.514846 -0.579732 0.254261
H 4.979006 0.039441 1.880524
H 6.153180 0.070900 0.515524
H 6.563913 2.420602 0.564160
H 5.509126 2.675423 1.999203
H 5.210885 3.585749 0.475214


