%chk=000019626.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019626

0 1
 O   -6.197100       1.181300      0.1344000    
 N    5.589500      0.3790000     -0.1807000    
 N   0.1008000     -0.3895000      0.6130000    
 N  -0.4745000     -0.5428000     -0.4900000    
 C    4.206700      0.1857000      1.9099999E-02
 C    3.345400       1.282700      4.4700000E-02
 C    3.700300      -1.102700      0.1910000    
 C    1.478500     -0.1959000      0.4135000    
 C    1.977900       1.091400      0.2426000    
 C    2.332800      -1.293900      0.3887000    
 C    6.232300       1.598300      0.2671000    
 C    6.388200     -0.6452000     -0.8241000    
 C   -4.075200      0.1671000     -6.6299997E-02
 C   -1.845500     -0.7357000     -0.2909000    
 C   -2.708000      0.3603000     -0.2645000    
 C   -4.579800      -1.121900      0.1056000    
 C   -2.350200      -2.024700     -0.1189000    
 C   -3.717400      -2.217800      7.9200000E-02
 C   -4.974900       1.309500     -3.8500000E-02
 C   -4.429600       2.714800     -0.2251000    
 H    3.705300       2.297600     -9.7599998E-02
 H    4.344500      -1.977400      0.1888000    
 H    1.313400       1.951100      0.2595000    
 H    1.946600      -2.300500      0.5252000    
 H    5.877500       1.897600       1.259800    
 H    6.051400       2.414700     -0.4400000    
 H    7.317300       1.467100      0.3472000    
 H    6.639400      -1.442900     -0.1171000    
 H    7.330000     -0.2319000      -1.202300    
 H    5.867300      -1.078800      -1.685300    
 H   -2.282600       1.350200     -0.4027000    
 H   -5.641000      -1.297300      0.2615000    
 H   -1.686400      -2.885100     -0.1385000    
 H   -4.110100      -3.221600      0.2127000    
 H   -3.963400       2.813400      -1.209000    
 H   -3.723500       2.957100      0.5734000    
 H   -5.255600       3.431500     -0.1715000    


%chk=000019626-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019626

0 1
O -6.274566 1.228837 0.132775
N 5.708201 0.399893 -0.122765
N 0.041106 0.102901 -0.060877
N -0.534390 -1.080135 -0.099383
C 4.319303 0.301298 -0.109395
C 3.491125 1.472320 -0.059747
C 3.666773 -0.981639 -0.143757
C 1.456673 0.086434 -0.080724
C 2.095403 1.357271 -0.045663
C 2.273770 -1.084058 -0.130223
C 6.354048 1.720463 -0.080625
C 6.539418 -0.812934 -0.174490
C -4.151788 0.088808 0.029502
C -1.966757 -1.031761 -0.073623
C -2.740450 0.158865 0.008150
C -4.797186 -1.181309 -0.032137
C -2.621129 -2.290138 -0.133309
C -4.031877 -2.361038 -0.113059
C -5.011380 1.322034 0.116855
C -4.334200 2.686703 0.187485
H 3.940666 2.468165 -0.032096
H 4.263244 -1.897582 -0.179418
H 1.461785 2.249953 -0.007295
H 1.781143 -2.061142 -0.156161
H 6.085476 2.277576 0.839113
H 6.070836 2.342288 -0.953261
H 7.447502 1.594465 -0.093555
H 6.369748 -1.463888 0.706068
H 7.602375 -0.527124 -0.185628
H 6.337695 -1.408170 -1.086975
H -2.204110 1.111337 0.052969
H -5.891812 -1.204331 -0.013967
H -2.002093 -3.191518 -0.194978
H -4.529133 -3.335742 -0.160465
H -3.707515 2.864027 -0.706329
H -3.671699 2.755057 1.070278
H -5.105905 3.468613 0.250708


