%chk=000131529.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131529

0 1
 O   0.9724000      -1.958000      1.4400000E-02
 O    5.843100       1.855000      0.9947000    
 O   -3.712600      -2.427500      0.1865000    
 O   -3.651000       2.569800     -7.1599998E-02
 N   0.5511000      0.8775000     -0.1310000    
 N   -4.174500      0.3001000      4.6999998E-02
 C    1.833300      0.3044000     -0.1388000    
 C  -0.4564000      6.3000001E-02 -5.4200001E-02
 C  -0.3023000      -1.413800      2.3499999E-02
 C    2.026500      -1.080200     -6.7400001E-02
 C    4.240500      0.5952000     -0.2305000    
 C    2.953900       1.137600     -0.2207000    
 C   -1.837000      0.6014000     -4.1299999E-02
 C   -2.904300     -0.1989000      3.6300000E-02
 C    3.310800      -1.627000     -7.6800004E-02
 C   -1.372500      -2.209300      0.1013000    
 C    4.418400     -0.7856000     -0.1584000    
 C   -2.749100      -1.671500      0.1139000    
 C    5.427200       1.495300     -0.3168000    
 C   -4.467600       1.652900     -2.0199999E-02
 C   -5.949800       1.919600      9.8999999E-03
 H    2.818300       2.215800     -0.2749000    
 H   -1.821600       1.676000     -0.1052000    
 H   -1.264400      -3.287600      0.1583000    
 H    3.453900      -2.702400     -2.0500001E-02
 H    5.415600      -1.217500     -0.1633000    
 H    6.264200       1.005800     -0.8258000    
 H    5.198000       2.408700     -0.8766000    
 H   -4.937200     -0.3698000      0.1060000    
 H   -6.145400       2.945100     -0.3156000    
 H   -6.321700       1.786800       1.029500    
 H   -6.475600       1.234900     -0.6618000    
 H    5.063800       2.162900       1.488200    


%chk=000131529-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131529

0 1
O 0.940571 -1.850007 0.076801
O 6.645586 1.115079 0.589100
O -3.841478 -2.280670 0.182375
O -4.028621 2.648191 -0.175295
N 0.601831 1.002950 -0.147183
N -4.242913 0.326338 -0.003805
C 1.870600 0.412361 -0.125002
C -0.468874 0.187640 -0.063796
C -0.344268 -1.283740 0.049730
C 2.056576 -1.000926 -0.011339
C 4.317949 0.671624 -0.189688
C 3.030039 1.233995 -0.209614
C -1.793296 0.756556 -0.083745
C -2.903720 -0.068371 0.000206
C 3.335351 -1.584901 0.020188
C -1.433026 -2.120713 0.131702
C 4.460817 -0.744911 -0.068062
C -2.773636 -1.566572 0.110935
C 5.559170 1.545325 -0.306162
C -4.764754 1.623427 -0.084878
C -6.285386 1.704963 -0.042187
H 2.872779 2.314955 -0.291437
H -1.892943 1.839602 -0.165485
H -1.316551 -3.203997 0.213384
H 3.431182 -2.670725 0.110525
H 5.469320 -1.169948 -0.039764
H 6.007549 1.459665 -1.311568
H 5.295059 2.610244 -0.140222
H -4.879706 -0.484858 0.068357
H -6.634708 2.330036 -0.880928
H -6.593972 2.209573 0.890671
H -6.781415 0.721227 -0.093383
H 6.332889 1.175287 1.527667


