%chk=000043662.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043662

0 1
 N   0.9206000     -0.7368000     -0.4505000    
 N    3.962500      -1.520400      0.6191000    
 C    2.915600      -1.400100     -0.3898000    
 C    2.221000     -3.2299999E-02 -0.3342000    
 C    1.571000      -1.945700      0.1115000    
 C  -5.7700001E-02 -0.1838000      0.4945000    
 C    3.395100      -1.875500      -1.732500    
 C   -1.398700     -0.9008000      0.3837000    
 C  -0.1197000       1.332600      0.4344000    
 C   -2.427800     -0.5937000     -0.5312000    
 C  -0.5990000       2.013600     -0.6982000    
 C   -2.441800      0.5427000      -1.532700    
 C   -1.137500       1.251600      -1.877500    
 C    4.980000     -0.4957000      0.4354000    
 C   -1.583900      -2.000100       1.257600    
 C   0.3442000       2.083500       1.530000    
 C   -3.607700      -1.374700     -0.5083000    
 C  -0.6057000       3.417900     -0.7150000    
 C   -2.751600      -2.760700       1.252900    
 C   0.3319000       3.478000       1.502800    
 C   -3.769000      -2.444800      0.3686000    
 C  -0.1419000       4.145200      0.3793000    
 H    2.385800      0.5127000      0.6041000    
 H    2.442800      0.6443000      -1.167000    
 H    1.243200      -2.884000     -0.3496000    
 H    1.516300      -2.074800       1.201100    
 H   0.2906000     -0.3835000       1.519900    
 H    2.583200      -1.880100      -2.469700    
 H    4.182100      -1.238000      -2.148100    
 H    3.781100      -2.900200      -1.682600    
 H    4.402700      -2.439100      0.6556000    
 H   -2.837600      0.1448000      -2.477500    
 H   -3.167900       1.285900      -1.174700    
 H   -1.332900       1.948500      -2.703200    
 H  -0.3899000      0.5525000      -2.265700    
 H    5.715900     -0.5912000       1.241400    
 H    4.592600      0.5249000      0.4980000    
 H    5.527500     -0.6128000     -0.5044000    
 H  -0.8067000      -2.273500       1.968900    
 H   0.7256000       1.587000       2.419500    
 H   -4.423000      -1.143000      -1.192000    
 H  -0.9801000       3.956000      -1.582500    
 H   -2.862300      -3.593600       1.940500    
 H   0.6944000       4.040900       2.357800    
 H   -4.685900      -3.025800      0.3576000    
 H  -0.1532000       5.230800      0.3549000    


%chk=000043662-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043662

0 1
N 0.984292 -0.473711 -0.297084
N 3.948949 -1.854841 0.492942
C 2.937057 -1.374367 -0.471225
C 2.389538 0.062870 -0.143803
C 1.489540 -1.889802 -0.144813
C -0.050849 0.012639 0.664295
C 3.309164 -1.554312 -1.960666
C -1.336279 -0.820373 0.525444
C -0.237851 1.524037 0.517793
C -2.303222 -0.676007 -0.516863
C -0.664293 2.099013 -0.714114
C -2.300286 0.377557 -1.631901
C -1.015446 1.202517 -1.886953
C 5.259144 -1.173072 0.457285
C -1.541908 -1.821095 1.514532
C 0.042101 2.366341 1.618846
C -3.421902 -1.555184 -0.519070
C -0.788803 3.506141 -0.805980
C -2.658001 -2.680992 1.498402
C -0.094208 3.770050 1.520916
C -3.609502 -2.547321 0.463059
C -0.507942 4.343565 0.298612
H 2.637714 0.348249 0.901824
H 2.638728 0.887942 -0.833109
H 1.025839 -2.616723 -0.833840
H 1.443952 -2.265482 0.900288
H 0.319636 -0.162469 1.707153
H 2.495477 -1.176829 -2.606082
H 4.232683 -1.002131 -2.216349
H 3.469398 -2.624145 -2.197366
H 4.045412 -2.879513 0.447649
H -2.571027 -0.135774 -2.576315
H -3.130338 1.085079 -1.422712
H -1.177748 1.819216 -2.791311
H -0.178257 0.506696 -2.078093
H 5.895599 -1.568094 1.269362
H 5.112702 -0.093786 0.647638
H 5.824309 -1.271644 -0.499579
H -0.802552 -1.918811 2.319508
H 0.369795 1.917177 2.564784
H -4.166988 -1.446959 -1.318393
H -1.112789 3.949104 -1.756085
H -2.782927 -3.439624 2.278819
H 0.124234 4.406086 2.385994
H -4.486505 -3.203249 0.423438
H -0.611441 5.430728 0.205321


