%chk=000062361.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062361

0 1
 O   0.2531000       3.932100      -1.318300    
 O   -3.071000       2.669300       1.298500    
 O  -0.6282000      -3.901600       1.317300    
 O   -3.575700      -1.935800      -1.317300    
 O    3.469800      -2.130000      -1.299900    
 O    3.698000       1.418200       1.301100    
 N   -1.098900       2.476900     -1.5799999E-02
 N   -1.618400      -2.183500      9.6000005E-03
 N    2.677600     -0.3029000      9.9999998E-03
 N   -1.390200      0.1502000     -2.0999999E-03
 N   0.8079000       1.112500     -2.2000000E-03
 N   0.5423000      -1.272100      1.0800000E-02
 C  -0.5330000       1.183800     -6.0000001E-03
 C  -0.7815000      -1.046600      6.2000002E-03
 C    1.291700     -0.1485000      6.0999999E-03
 C  -0.2576000       3.661400     -1.8300001E-02
 C   -2.538900       2.662200     -2.0600000E-02
 C   -1.058400      -3.524100      1.4700000E-02
 C   -3.063700      -2.047100      5.1000002E-03
 C    3.299200      -1.624700      1.8700000E-02
 C    3.575800      0.8503000      2.3000001E-03
 H   0.5820000       3.558400      0.6790000    
 H  -0.8270000       4.540600      0.3045000    
 H   -2.801100       3.621200     -0.4814000    
 H   -3.058500       1.895900     -0.6072000    
 H   -1.805200      -4.256100     -0.3135000    
 H  -0.2122000      -3.607700     -0.6771000    
 H   -3.533700      -2.925300      0.4621000    
 H   -3.405600      -1.185700      0.5902000    
 H    2.722600      -2.350400      0.6036000    
 H    4.290500      -1.580500      0.4834000    
 H    4.578100      0.5580000     -0.3312000    
 H    3.223900       1.622400     -0.6917000    
 H   0.8007000       4.732600      -1.248700    
 H   -2.767000       1.852100       1.728300    
 H  -0.2697000      -4.802900       1.249300    
 H   -3.096400      -1.205300      -1.743300    
 H    2.599900      -2.086400      -1.731700    
 H    4.305200       2.174000       1.225700    


%chk=000062361-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000062361

0 1
O -0.403252 4.364132 -1.332871
O -3.204504 2.073480 1.053541
O -1.248316 -4.073690 1.355641
O -3.463743 -1.360736 -1.199007
O 3.053649 -2.444901 -0.993871
O 4.312693 1.097087 1.217022
N -1.081144 2.485378 -0.083209
N -1.486687 -2.183196 -0.024571
N 2.797201 -0.223348 -0.014661
N -1.305209 0.151504 -0.053535
N 0.897347 1.189527 -0.053244
N 0.690022 -1.238460 -0.035332
C -0.465531 1.247611 -0.074688
C -0.667415 -1.070056 -0.027359
C 1.424630 -0.071180 -0.025542
C -0.325157 3.716433 -0.005315
C -2.556400 2.554530 -0.152781
C -0.968881 -3.533264 0.008809
C -2.955915 -1.986137 0.005005
C 3.355657 -1.588312 0.137543
C 3.696156 0.904234 -0.114129
H 0.715295 3.465257 0.261036
H -0.783837 4.371906 0.763847
H -2.837275 3.611390 -0.258004
H -2.894424 1.991498 -1.043488
H -1.490984 -4.139732 -0.759945
H 0.115142 -3.500825 -0.191644
H -3.424576 -2.977807 0.068343
H -3.213445 -1.396865 0.906084
H 2.962880 -2.019247 1.077900
H 4.449748 -1.501060 0.190505
H 4.480897 0.673398 -0.864357
H 3.109096 1.787641 -0.417749
H 0.011324 5.263682 -1.281449
H -3.010064 1.098110 1.105274
H -0.944849 -5.016879 1.400604
H -3.081967 -0.439767 -1.210492
H 2.057351 -2.525201 -0.987718
H 5.010886 1.798767 1.154007


