%chk=000033704.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033704

0 1
 O   0.4017000       1.365400     -0.6383000    
 O   -1.011000       1.661500       1.308600    
 O   -1.118100       4.358700      0.7751000    
 O  -0.8492000       3.727000      -1.390200    
 O    5.385100      -1.936200       1.256200    
 O   -5.033400      -2.317000      -1.396500    
 O    5.771500      -1.861900     -0.9079000    
 O   -4.167900      -3.629600      0.1417000    
 N    5.072600      -1.580500      9.4899997E-02
 N   -4.250000      -2.520700     -0.4385000    
 C  -8.7099999E-02   2.236300      0.3839000    
 C    1.543100      0.6460000     -0.4593000    
 C   -1.807400      0.6337000      0.8795000    
 C    1.914600      0.2346000      0.8208000    
 C   -2.682000      0.8365000     -0.1828000    
 C    2.340700      0.3190000      -1.555800    
 C   -1.733600     -0.6044000       1.508800    
 C    3.881300     -0.8307000     -9.2299998E-02
 C   -3.423300      -1.455100      6.0000001E-03
 C    3.083700     -0.5038000       1.004300    
 C   -3.492400     -0.2110000     -0.6209000    
 C    3.509800     -0.4195000      -1.372300    
 C   -2.543900      -1.651800       1.070700    
 C  -0.7049000       3.503400     -0.1956000    
 H   0.7661000       2.610100      0.9671000    
 H    1.315100      0.4580000       1.697200    
 H   -2.764700       1.800100     -0.6742000    
 H    2.055700      0.6370000      -2.555000    
 H   -1.050900     -0.7618000       2.338900    
 H    3.340300     -0.8094000       2.015500    
 H   -4.168200     -1.9800000E-02  -1.450600    
 H    4.106300     -0.6553000      -2.249900    
 H   -2.463100      -2.606900       1.583300    
 H   -1.530500       5.165800      0.3997000    


%chk=000033704-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033704

0 1
O 0.661966 1.565290 -0.630701
O -0.699266 1.119419 1.344775
O -1.136239 4.141823 1.026948
O -1.480655 3.289362 -1.115092
O 5.865796 -1.809436 0.966209
O -5.225009 -2.340423 -1.598096
O 6.129428 -1.618661 -1.293162
O -5.517092 -2.961967 0.578606
N 5.480325 -1.401511 -0.197603
N -4.919071 -2.282346 -0.344034
C -0.002397 2.113718 0.528168
C 1.844015 0.814452 -0.434935
C -1.743382 0.315225 0.822745
C 2.278802 0.333957 0.825533
C -2.098091 0.232913 -0.546699
C 2.579707 0.558534 -1.616649
C -2.416958 -0.448335 1.807580
C 4.216500 -0.635511 -0.281370
C -3.816955 -1.383080 0.061882
C 3.482013 -0.393314 0.898737
C -3.147656 -0.626378 -0.923509
C 3.775409 -0.172859 -1.543152
C -3.461580 -1.305380 1.428456
C -0.952293 3.214517 0.007088
H 0.716834 2.551464 1.241672
H 1.680664 0.487233 1.727473
H -1.572587 0.815672 -1.305498
H 2.204550 0.944539 -2.568263
H -2.110602 -0.353574 2.852899
H 3.852817 -0.783931 1.849880
H -3.451925 -0.718349 -1.969227
H 4.372271 -0.386101 -2.433296
H -4.004339 -1.907119 2.161490
H -1.779000 4.847859 0.743244


