%chk=000122310.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122310

0 1
 O    2.034500      -1.916800       1.436000    
 O    6.476300     -0.2965000      -1.697200    
 O    6.865600       1.757100      0.1342000    
 O   -7.726500       1.468400     -0.3316000    
 N  -0.3923000      -1.199700      0.1152000    
 C   0.8009000     -0.3479000      3.4600001E-02
 C   -1.598900     -0.3934000      5.2600000E-02
 C    2.069700      -1.216400      0.1894000    
 C   -2.833300      -1.313500      5.4900002E-02
 C   0.7591000      0.3983000      -1.300100    
 C   -1.590100      0.5779000       1.233100    
 C    3.357300     -0.4205000      0.1721000    
 C   -4.142700     -0.5688000     -4.8599999E-02
 C    4.329400     -0.7301000     -0.7629000    
 C    3.533700      0.5983000       1.091600    
 C   -4.784300     -0.1601000       1.109300    
 C   -4.678200     -0.3084000      -1.299800    
 C    5.516100      2.7999999E-03 -0.7787000    
 C    4.720200       1.331200       1.076000    
 C    5.711500       1.033700      0.1408000    
 C   -5.994100      0.5276000       1.013600    
 C   -5.888000      0.3794000      -1.395600    
 C   -6.545900      0.7975000     -0.2388000    
 H   0.8243000      0.3641000      0.8612000    
 H   -1.669000      0.1793000     -0.8779000    
 H    2.092100      -1.978000     -0.6010000    
 H  -0.3856000      -1.878100     -0.6461000    
 H   -2.843600      -1.930900      0.9642000    
 H   -2.767900      -2.028400     -0.7774000    
 H    1.720800      0.8756000      -1.516600    
 H   0.5457000     -0.2730000      -2.140100    
 H   3.1599998E-02   1.215900      -1.307200    
 H  -0.8402000       1.368800       1.138700    
 H   -1.439100      5.9799999E-02   2.187100    
 H   -2.529400       1.131800       1.308000    
 H    4.175400      -1.532800      -1.478900    
 H    2.781800      0.8360000       1.837600    
 H    1.198100      -2.412000       1.466000    
 H   -4.369300     -0.3720000       2.090500    
 H   -4.171800     -0.6280000      -2.206100    
 H    4.867700       2.130700       1.796900    
 H   -6.502900      0.8490000       1.918300    
 H   -6.307000      0.5837000      -2.377200    
 H    6.167900      -1.035400      -2.249300    
 H    7.436300       1.416200     -0.5763000    
 H   -7.959500       1.567400      -1.270700    


%chk=000122310-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122310

0 1
O 1.613070 -1.586441 1.540201
O 6.633710 0.095337 -1.510296
O 6.807349 2.018853 0.381068
O -7.859861 1.582043 0.088258
N -0.381372 -1.185371 -0.133502
C 0.884272 -0.491496 -0.521664
C -1.603895 -0.339266 0.028298
C 2.066300 -1.250473 0.194446
C -2.845605 -1.278720 -0.013121
C 1.084131 -0.380532 -2.045629
C -1.538111 0.462643 1.343205
C 3.335670 -0.417670 0.263978
C -4.172488 -0.535846 -0.003143
C 4.379367 -0.616087 -0.674907
C 3.477029 0.594368 1.245215
C -4.967435 -0.453793 1.170240
C -4.645066 0.114507 -1.171308
C 5.525651 0.197752 -0.630981
C 4.630059 1.408092 1.288086
C 5.658697 1.219019 0.344946
C -6.187179 0.252529 1.186978
C -5.863858 0.826741 -1.175696
C -6.634197 0.895351 0.010472
H 0.844422 0.521185 -0.079615
H -1.698841 0.380677 -0.820208
H 2.269402 -2.181334 -0.388278
H -0.565727 -1.980553 -0.765057
H -2.780464 -1.970124 0.848705
H -2.776295 -1.898977 -0.932029
H 2.016220 0.162020 -2.283499
H 1.147699 -1.385551 -2.508313
H 0.244072 0.162172 -2.516702
H -0.652422 1.121347 1.374777
H -1.479798 -0.224853 2.206816
H -2.435760 1.095582 1.452230
H 4.297092 -1.413419 -1.426727
H 2.691249 0.706188 1.998378
H 0.613765 -1.697614 1.402051
H -4.627723 -0.952731 2.085668
H -4.058359 0.057421 -2.096752
H 4.754552 2.184936 2.048436
H -6.801316 0.314213 2.090177
H -6.212405 1.318218 -2.093713
H 6.537299 -0.662047 -2.135077
H 7.421184 1.724255 -0.342328
H -8.087687 1.997248 -0.780287


