%chk=000123773.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123773

0 1
 O    2.669700     -6.7900002E-02   1.106500    
 O    2.105200      -2.890100     -6.7299999E-02
 O    3.894800      -1.753200      -1.815800    
 O    5.206400       1.150300       1.246400    
 O   -3.331300       2.734400     -0.4567000    
 N   0.4981000      0.3288000      0.2513000    
 N  -0.4040000       2.389000     -0.1588000    
 N   -1.726600     -0.8627000      0.2766000    
 N   -3.649800      0.4786000     -0.1065000    
 N   -3.812800      -1.839300      0.2757000    
 C    1.448500     -0.6835000      0.6493000    
 C    1.818000      -1.572900     -0.5329000    
 C    3.064000     -0.8935000      -1.065800    
 C    3.737400     -0.4172000      0.2097000    
 C   0.8939000       1.739600      8.9199997E-02
 C  -0.8892000      0.2086000      0.1559000    
 C   -1.400700       1.430400     -9.1799997E-02
 C    4.641600      0.7846000     -3.0000001E-04
 C  -0.5123000       3.809100     -0.3535000    
 C   -2.865600       1.621300     -0.2363000    
 C   -3.088500     -0.6834000      0.1369000    
 C   -5.063300      -2.012700     -0.4289000    
 C   -3.233400      -2.998300      0.9170000    
 H    1.047800      -1.264200       1.488000    
 H    1.030900      -1.664000      -1.288000    
 H    2.783100     -3.9900001E-02  -1.694100    
 H    4.309700      -1.223500      0.6859000    
 H    1.560300       1.870000     -0.7687000    
 H    1.348400       2.138000       1.002600    
 H    4.075900       1.644300     -0.3730000    
 H    5.449700      0.5518000     -0.7004000    
 H    2.451400      -3.394500     -0.8231000    
 H   -1.285200      -1.763200      0.4122000    
 H    3.370400      -2.085800      -2.564000    
 H   -1.029300       4.032300      -1.292100    
 H   0.4757000       4.279100     -0.3986000    
 H   -1.065900       4.269100      0.4711000    
 H    5.779900       1.919200       1.087000    
 H   -5.583000      -2.927800     -0.1257000    
 H   -4.885700      -2.070000      -1.507900    
 H   -5.744700      -1.177900     -0.2324000    
 H   -2.676800      -2.728600       1.821900    
 H   -2.573900      -3.538000      0.2289000    
 H   -4.010500      -3.699700       1.241600    


%chk=000123773-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123773

0 1
O 1.905564 -0.644511 0.599637
O 2.711070 -2.419979 -1.982347
O 4.914344 -0.968162 -1.434957
O 4.035545 -0.486824 2.765586
O -3.532454 2.777723 -0.396697
N 0.285570 0.095804 -1.058266
N -0.632745 2.229904 -1.322256
N -1.719414 -0.929334 0.036690
N -3.627420 0.522404 0.295170
N -3.745160 -1.741854 0.983158
C 1.264881 -0.907623 -0.752381
C 2.438356 -1.003614 -1.758499
C 3.643925 -0.361937 -1.010729
C 3.376715 -0.732850 0.464348
C 0.671276 1.522337 -1.298909
C -1.005894 0.140590 -0.483251
C -1.564370 1.392835 -0.634893
C 4.042646 0.197207 1.468110
C -0.612539 3.680369 -1.094222
C -2.954551 1.648627 -0.256786
C -3.052647 -0.667859 0.433161
C -5.126254 -1.544608 1.453330
C -3.137553 -3.071224 1.105529
H 0.776797 -1.898257 -0.704242
H 2.202383 -0.504301 -2.718022
H 3.654000 0.737700 -1.149342
H 3.720360 -1.770819 0.645894
H 1.213708 1.633232 -2.258095
H 1.324059 1.894490 -0.460280
H 3.479043 1.154365 1.502363
H 5.085918 0.390028 1.134133
H 3.703427 -2.515980 -2.034607
H -1.259000 -1.813080 0.254268
H 5.317374 -0.445932 -2.172551
H -1.657031 4.022979 -1.015710
H -0.121488 4.192081 -1.941857
H -0.077542 3.953687 -0.153322
H 4.291682 0.148958 3.479174
H -5.208429 -1.758373 2.536550
H -5.825733 -2.202310 0.902407
H -5.394473 -0.493770 1.266328
H -2.279136 -3.086165 1.811457
H -2.803906 -3.471321 0.125395
H -3.892605 -3.767932 1.500631


