%chk=000019159.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019159

0 1
 N    2.878800       2.710600     -8.0399998E-02
 N    2.838400      -1.806000       1.971500    
 C    1.457000     -0.9090000     -0.1078000    
 C    1.526600      -2.000000      -1.259500    
 C    2.161600      0.4143000     -0.5778000    
 C  -2.6400000E-02 -0.6177000      0.2207000    
 C    2.198300       1.541000      0.4692000    
 C   0.8818000      -3.342100     -0.8643000    
 C    2.946900      -2.279000      -1.781600    
 C  -0.8265000     -0.1484000     -0.7855000    
 C    2.225700      -1.414300       1.066400    
 C  -0.4562000     -0.8444000       1.496300    
 C   -2.175700      0.1211000     -0.5034000    
 C   -2.666500     -9.8899998E-02  0.8057000    
 C   -1.793600     -0.5819000       1.794100    
 C    2.958300       3.775000      0.9203000    
 C    2.190200       3.188800      -1.279400    
 C   -3.048400      0.6041000      -1.491800    
 C   -4.015700      0.1707000       1.087800    
 C   -4.385900      0.8664000      -1.193900    
 C   -4.868700      0.6501000      9.3300000E-02
 H   0.9668000      -1.634000      -2.129900    
 H    3.205400      0.1996000     -0.8421000    
 H    1.671300      0.7373000      -1.500800    
 H    1.182400       1.800500      0.7912000    
 H    2.743400       1.196500       1.355400    
 H   0.8958000      -4.036800      -1.711800    
 H    1.416500      -3.822100     -3.8300000E-02
 H  -0.1650000      -3.220700     -0.5710000    
 H    3.622300      -2.600700     -0.9831000    
 H    2.928900      -3.074000      -2.536100    
 H    3.377100      -1.400200      -2.269700    
 H  -0.4517000      2.7300000E-02  -1.789200    
 H   0.1610000      -1.214700       2.304700    
 H   -2.150100     -0.7580000       2.807100    
 H    3.521000       4.630500      0.5301000    
 H    3.496300       3.428600       1.809900    
 H    1.967400       4.125800       1.230800    
 H    1.109300       3.295900      -1.131100    
 H    2.379100       2.546200      -2.144600    
 H    2.579500       4.170700      -1.576400    
 H   -2.693200      0.7807000      -2.504900    
 H   -4.414500      8.8999998E-03   2.087100    
 H   -5.050500       1.239700      -1.967600    
 H   -5.910100      0.8545000      0.3244000    


%chk=000019159-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019159

0 1
N 2.844371 2.772831 -0.177151
N 2.871655 -1.750972 1.987308
C 1.493517 -0.910743 -0.147542
C 1.579971 -2.061563 -1.249896
C 2.182772 0.405096 -0.665115
C 0.005474 -0.641907 0.202834
C 2.123390 1.580216 0.333285
C 0.907153 -3.367083 -0.765251
C 3.025476 -2.345736 -1.720684
C -0.854521 -0.136646 -0.781506
C 2.238912 -1.372172 1.048922
C -0.526337 -0.911113 1.507648
C -2.238500 0.115448 -0.515092
C -2.764738 -0.160849 0.806246
C -1.871385 -0.677453 1.799239
C 3.217815 3.702089 0.910067
C 2.119828 3.469305 -1.260066
C -3.124074 0.635734 -1.518291
C -4.151311 0.091186 1.073894
C -4.469638 0.871952 -1.229372
C -4.988753 0.597259 0.077677
H 1.001754 -1.672684 -2.113110
H 3.245738 0.208704 -0.884895
H 1.694450 0.677092 -1.619643
H 1.060011 1.816605 0.588241
H 2.619330 1.266701 1.271569
H 0.905093 -4.114642 -1.579033
H 1.458771 -3.801988 0.089155
H -0.137698 -3.200034 -0.451864
H 3.668959 -2.647681 -0.873471
H 3.019923 -3.177822 -2.448319
H 3.490738 -1.476340 -2.215763
H -0.478914 0.083686 -1.788692
H 0.137183 -1.305512 2.284736
H -2.258140 -0.889822 2.803112
H 3.823097 4.529646 0.497819
H 3.831046 3.171013 1.659376
H 2.336983 4.150293 1.437001
H 1.124945 3.869815 -0.935203
H 1.952467 2.790655 -2.114258
H 2.728450 4.316690 -1.623199
H -2.728367 0.845948 -2.519481
H -4.544950 -0.119600 2.075466
H -5.136879 1.269090 -2.002254
H -6.046666 0.787205 0.289554


