%chk=000063463.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063463

0 1
 O    1.504600       2.471900     -0.5158000    
 N   0.1950000      0.5412000     -0.1872000    
 N    1.297600      -1.544700      0.1903000    
 N   -2.714700      -2.828900      -1.243600    
 C   -1.025700       1.305300     -0.1855000    
 C   0.2099000     -0.8531000      3.5399999E-02
 C    2.636800      0.4654000     -0.1924000    
 C    1.399000       1.260600     -0.3376000    
 C    2.532300     -0.8957000      9.4800003E-02
 C   -1.503300       1.869300      0.9914000    
 C   -1.055500      -1.626100      2.1900000E-02
 C   -1.715100       1.468000      -1.381500    
 C    3.891700       1.075700     -0.3090000    
 C   -2.687300       2.606600      0.9724000    
 C    3.703200      -1.644400      0.2645000    
 C  -0.7761000       1.706700       2.286700    
 C   -2.899100       2.205200      -1.400500    
 C   -3.385200       2.774600     -0.2236000    
 C    5.049700      0.3185000     -0.1380000    
 C    4.956100      -1.040700      0.1499000    
 C   -1.747100      -1.869400       1.197000    
 C   -1.567900      -2.117700      -1.161600    
 C   -2.930900      -2.597500       1.153100    
 C   -3.368100      -3.050800     -8.1000000E-02
 H   -1.343700       1.031100      -2.304600    
 H    3.987500       2.135500     -0.5280000    
 H   -3.078900       3.058200       1.880000    
 H    3.645300      -2.707900      0.4839000    
 H   0.1259000       2.327400       2.291900    
 H   -1.395500       2.013600       3.136700    
 H  -0.4928000      0.6665000       2.466000    
 H   -3.442200       2.336400      -2.331900    
 H   -4.306800       3.348900     -0.2387000    
 H    6.024400      0.7890000     -0.2273000    
 H    5.857500      -1.631600      0.2831000    
 H   -1.376500      -1.510400       2.152100    
 H   -1.064700      -1.955200      -2.109600    
 H   -3.492500      -2.805200       2.056700    
 H   -4.285400      -3.623700     -0.1690000    


%chk=000063463-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063463

0 1
O 1.400945 2.532719 0.265912
N 0.201989 0.512079 0.083051
N 1.331361 -1.605288 -0.208726
N -2.290799 -3.595472 -0.922049
C -1.039482 1.281595 0.005437
C 0.216430 -0.901504 -0.051314
C 2.657786 0.474924 -0.006924
C 1.429720 1.275807 0.136002
C 2.564785 -0.938422 -0.207512
C -1.513251 2.006559 1.131943
C -1.058684 -1.674360 -0.010176
C -1.725059 1.303046 -1.229320
C 3.926352 1.110811 0.016448
C -2.714785 2.742266 0.972703
C 3.754966 -1.697456 -0.387506
C -0.771497 2.014404 2.452456
C -2.919601 2.040531 -1.362107
C -3.415095 2.764009 -0.253792
C 5.093887 0.349992 -0.160157
C 5.004457 -1.057098 -0.364635
C -2.105522 -1.433960 0.915904
C -1.203654 -2.775472 -0.899742
C -3.233500 -2.280521 0.910002
C -3.289131 -3.340601 -0.022915
H -1.318008 0.744388 -2.078850
H 3.961007 2.194626 0.166873
H -3.100299 3.309734 1.827872
H 3.660510 -2.777351 -0.535030
H 0.115703 2.669389 2.377484
H -1.413734 2.388186 3.267664
H -0.404148 1.009224 2.732449
H -3.451127 2.054027 -2.319180
H -4.339962 3.344167 -0.344393
H 6.074494 0.836964 -0.142302
H 5.919058 -1.644134 -0.502372
H -2.039817 -0.616229 1.638145
H -0.402243 -3.004196 -1.609324
H -4.053509 -2.125783 1.617650
H -4.149046 -4.019002 -0.058271


