%chk=000065422.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065422

0 1
 O    2.333700      -2.330300     -0.5766000    
 O    3.076300       2.269900     -0.3239000    
 O    7.162400     -0.9026000       1.370200    
 O   -7.829700      0.2680000     -0.1869000    
 N    2.756200     -3.5300002E-02 -0.5273000    
 N   -3.627300     -0.3410000      0.3814000    
 C   2.2000000E-02  0.3834000     -7.7299997E-02
 C   0.4900000     -0.9275000     -0.2438000    
 C   -1.363300      0.5965000      0.1348000    
 C   0.8825000       1.489600     -0.1112000    
 C   -2.235300     -0.5019000      0.1727000    
 C    1.931800      -1.173900     -0.4659000    
 C    4.169800     -0.2489000     -0.8186000    
 C    2.332500       1.291600     -0.3313000    
 C  -0.3932000      -2.013700     -0.2027000    
 C   -1.752400      -1.797800      4.9999999E-03
 C   -1.845100       1.903100      0.3051000    
 C   0.3860000       2.788000      6.1400000E-02
 C    4.996800     -0.4772000      0.4397000    
 C  -0.9753000       2.990700      0.2686000    
 C   -4.532400      -1.443200      0.4244000    
 C   -5.975500      -1.005100      0.6364000    
 C    6.477800     -0.6815000      0.1442000    
 C   -6.488300     -0.1012000     -0.4782000    
 H    4.560800      0.6191000      -1.362700    
 H    4.271600      -1.113000      -1.486100    
 H  -4.1099999E-02  -3.033900     -0.3308000    
 H   -2.389500      -2.676200      2.8800000E-02
 H   -2.893600       2.132900      0.4640000    
 H    1.042600       3.653500      3.6300000E-02
 H    4.880500      0.3698000       1.128100    
 H    4.611900      -1.345700      0.9895000    
 H   -3.976500      0.5689000      0.6480000    
 H   -1.359500       3.998100      0.4004000    
 H   -4.268400      -2.119300       1.246900    
 H   -4.489000      -2.014600     -0.5113000    
 H   -6.622200      -1.887900      0.7134000    
 H   -6.072300     -0.4805000       1.595900    
 H    6.641900      -1.544100     -0.5093000    
 H    6.908000      0.2041000     -0.3331000    
 H   -5.896800      0.8152000     -0.5614000    
 H   -6.471700     -0.6234000      -1.440100    
 H    6.796000      -1.709800       1.769800    
 H   -8.133600      0.8366000     -0.9149000    


%chk=000065422-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000065422

0 1
O 2.459853 -2.273009 -0.737978
O 3.168693 2.333678 -0.404434
O 7.256055 -1.104008 1.387502
O -7.909186 0.243934 -0.283280
N 2.790953 0.035249 -0.589675
N -3.637769 -0.354578 0.460871
C 0.007201 0.427301 -0.078274
C 0.520129 -0.892642 -0.292103
C -1.398566 0.637982 0.175436
C 0.893088 1.553303 -0.116755
C -2.286472 -0.521612 0.219898
C 1.952499 -1.122512 -0.550977
C 4.239230 -0.182143 -0.841651
C 2.348457 1.364955 -0.372945
C -0.362983 -1.987103 -0.247569
C -1.739066 -1.814001 0.004322
C -1.858017 1.976714 0.370409
C 0.407211 2.854312 0.087922
C 5.009306 -0.514462 0.456338
C -0.974510 3.065944 0.329803
C -4.608228 -1.457262 0.553506
C -6.044727 -0.916934 0.679961
C 6.501168 -0.765590 0.170112
C -6.555658 -0.235727 -0.596605
H 4.631932 0.744157 -1.292408
H 4.324992 -1.017861 -1.556941
H 0.051235 -2.987868 -0.409769
H -2.385631 -2.693923 0.043746
H -2.918975 2.188539 0.550966
H 1.117966 3.686063 0.052592
H 4.914426 0.319256 1.175525
H 4.562768 -1.419076 0.914453
H -3.978810 0.569486 0.722903
H -1.352435 4.081693 0.482866
H -4.375116 -2.102282 1.427060
H -4.526119 -2.096002 -0.349750
H -6.723670 -1.753606 0.923579
H -6.114408 -0.200481 1.522348
H 6.615875 -1.562595 -0.597238
H 6.988586 0.150805 -0.204170
H -5.893123 0.607823 -0.889353
H -6.570102 -0.967269 -1.433606
H 6.859537 -1.919247 1.787562
H -8.308490 0.670100 -1.082598


