%chk=000050009.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050009

0 1
 I   -6.363800      -1.773000     -8.8000000E-03
 O    2.392300     -3.2400001E-02 -9.3999999E-03
 O   0.2315000      0.4484000     -9.9999997E-05
 O    1.751100       2.181500      1.3800000E-02
 C    4.624200     -0.8996000     -2.3499999E-02
 C    6.111500     -0.5584000     -7.8999996E-03
 C    3.759900      0.3532000     -9.1000004E-03
 C    6.970500      -1.812400      2.1100000E-02
 C   -2.148700      0.6426000      5.7000001E-03
 C  -0.8472000       1.389400      1.0600000E-02
 C   -2.748200      0.3118000      -1.204200    
 C   -2.743200      0.2888000       1.211700    
 C    1.482600      0.9877000      2.9000000E-03
 C   -3.958300     -0.3821000      -1.208100    
 C   -3.953300     -0.4050000       1.207600    
 C   -4.560800     -0.7405000     -2.2000000E-03
 H    4.381000      -1.500400     -0.9089000    
 H    4.369100      -1.524600      0.8416000    
 H    6.344200      5.4900002E-02  0.8704000    
 H    6.366800      3.3900000E-02 -0.8942000    
 H    3.971200      0.9447000      0.8896000    
 H    3.968100      0.9626000     -0.8965000    
 H    6.763000      -2.409600      0.9147000    
 H    6.784900      -2.435300     -0.8596000    
 H    8.031700      -1.544800      3.0400001E-02
 H  -0.7799000       2.039800     -0.8705000    
 H  -0.7770000       2.023000      0.9036000    
 H   -2.286500      0.5844000      -2.149200    
 H   -2.277600      0.5435000       2.159800    
 H   -4.414500     -0.6340000      -2.162100    
 H   -4.405500     -0.6750000       2.158600    


%chk=000050009-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050009

0 1
I -6.482171 -1.856494 -0.007385
O 2.402790 -0.038539 0.002001
O 0.220195 0.430339 0.001646
O 1.747377 2.220206 0.011407
C 4.674586 -0.886837 -0.001235
C 6.191086 -0.578069 0.000898
C 3.837615 0.390608 0.005330
C 7.047708 -1.862294 -0.003557
C -2.192692 0.678541 0.001907
C -0.894622 1.443365 0.004730
C -2.813530 0.316072 -1.218450
C -2.813873 0.307707 1.219577
C 1.487743 0.993159 0.005994
C -4.028738 -0.404071 -1.232195
C -4.029086 -0.412510 1.228061
C -4.625390 -0.761788 -0.003368
H 4.414908 -1.487264 -0.893756
H 4.414312 -1.496696 0.884675
H 6.444357 0.032175 0.891516
H 6.445441 0.039215 -0.884536
H 4.017267 1.006807 0.905853
H 4.018658 1.017151 -0.887727
H 6.836435 -2.482332 0.887523
H 6.835424 -2.476794 -0.898255
H 8.126910 -1.625110 -0.003459
H -0.777227 2.081112 -0.889097
H -0.777594 2.075278 0.902731
H -2.345511 0.591817 -2.170617
H -2.346117 0.576907 2.173746
H -4.498271 -0.676817 -2.181164
H -4.498889 -0.691745 2.175007


