%chk=000077541.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077541

0 1
 O   -1.574100      0.2331000      0.9290000    
 O    3.761400      0.2268000     -0.4543000    
 O   -2.093500     -0.3461000      -1.262200    
 N   -3.766400     -5.9500001E-02  0.3193000    
 C  -0.2563000      0.2320000      0.5885000    
 C    2.444000      0.2281000     -0.1125000    
 C   0.3446000       1.400900      0.1213000    
 C   0.4928000     -0.9389000      0.7052000    
 C    1.694600       1.398900     -0.2292000    
 C    1.843000     -0.9409000      0.3548000    
 C   -2.458700     -8.5800000E-02 -0.1195000    
 C    4.468400      -1.004200     -0.3105000    
 C   -4.899600     -0.3443000     -0.5298000    
 H  -0.2332000       2.316400      2.8200001E-02
 H   2.9800000E-02  -1.852300       1.068900    
 H    2.157300       2.312400     -0.5925000    
 H    2.365600      -1.884300      0.4699000    
 H   -3.941900      0.1723000       1.292100    
 H    4.506600      -1.326400      0.7357000    
 H    5.500700     -0.8229000     -0.6269000    
 H    4.063600      -1.780000     -0.9693000    
 H   -4.585100     -0.5827000      -1.548500    
 H   -5.548900      0.5345000     -0.5381000    
 H   -5.442500      -1.190400     -0.1016000    


%chk=000077541-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077541

0 1
O -1.646260 0.210829 0.815882
O 3.866026 0.274585 -0.368263
O -2.301535 -0.456303 -1.375167
N -3.851342 -0.010281 0.342882
C -0.259106 0.181116 0.466652
C 2.497205 0.166778 -0.073072
C 0.372655 1.372357 0.049627
C 0.468553 -1.011891 0.614155
C 1.752877 1.365402 -0.219152
C 1.856004 -1.026413 0.344608
C -2.595922 -0.122620 -0.205689
C 4.678914 -0.937949 -0.251088
C -5.065367 -0.288460 -0.427416
H -0.215483 2.288549 -0.060067
H -0.046207 -1.922662 0.935537
H 2.274158 2.270215 -0.544795
H 2.413995 -1.959873 0.459878
H -3.908813 0.277933 1.319759
H 4.677895 -1.325603 0.786572
H 5.696859 -0.628970 -0.529846
H 4.325846 -1.727631 -0.942799
H -4.761891 -0.578838 -1.445791
H -5.713455 0.604988 -0.493618
H -5.643406 -1.118559 0.019211


