%chk=000039850.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039850

0 1
 O   -1.718700     -0.9679000      3.1800002E-02
 O   -2.091000       1.216500      0.6874000    
 C   0.4478000      7.8400001E-02 -0.2129000    
 C    1.629800     -0.7475000     -0.8386000    
 C    1.208700       1.109100      0.6690000    
 C    2.882800     -7.1099997E-02 -0.2283000    
 C    2.407000      0.3027000       1.181800    
 C  -0.4068000     -0.9276000      0.5768000    
 C    1.954500       2.032300     -0.2707000    
 C    2.959000       1.323700     -0.8092000    
 C    1.371200      -2.145200     -0.3808000    
 C   0.2665000      -2.242800      0.3635000    
 C   -2.450700      0.1767000      0.1583000    
 C   -3.772800     -5.5599999E-02 -0.4595000    
 C   -4.687400      0.9183000     -0.4687000    
 H  -0.1164000      0.5833000      -1.007900    
 H    1.619700     -0.6989000      -1.933900    
 H   0.6269000       1.616300       1.439400    
 H    3.814100     -0.6382000     -0.2651000    
 H    2.132600     -0.5546000       1.803600    
 H    3.133600      0.9104000       1.737700    
 H  -0.4601000     -0.6986000       1.647700    
 H    1.690200       3.051000     -0.5052000    
 H    3.655300       1.664900      -1.558300    
 H    2.002800      -2.983700     -0.6377000    
 H  -9.4899997E-02  -3.171000      0.7835000    
 H   -3.986400      -1.022000     -0.9021000    
 H   -5.657800      0.7471000     -0.9226000    
 H   -4.503500       1.894800     -3.4600001E-02


%chk=000039850-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039850

0 1
O -1.755115 -0.895624 -0.160585
O -2.318523 1.078101 0.969272
C 0.560066 0.132489 -0.312265
C 1.751258 -0.759449 -0.849105
C 1.291371 1.191277 0.601840
C 3.019183 -0.097913 -0.145319
C 2.413863 0.306827 1.234739
C -0.382195 -0.835110 0.465276
C 2.132546 2.056181 -0.348733
C 3.167735 1.286687 -0.795309
C 1.402435 -2.156834 -0.374859
C 0.242942 -2.202920 0.333481
C -2.628310 0.140356 0.190363
C -3.937198 -0.050591 -0.489460
C -4.957459 0.827990 -0.311626
H -0.002561 0.623478 -1.122702
H 1.875579 -0.724012 -1.946770
H 0.611451 1.724619 1.281927
H 3.914764 -0.737978 -0.137998
H 2.035438 -0.550775 1.818652
H 3.118068 0.893197 1.847624
H -0.539250 -0.508766 1.511747
H 1.869067 3.068643 -0.666276
H 3.916198 1.546046 -1.549073
H 2.040781 -3.022922 -0.582499
H -0.207165 -3.093013 0.782901
H -4.025655 -0.931362 -1.133819
H -5.923485 0.693332 -0.809073
H -4.829830 1.698846 0.342048