%chk=000057883.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057883

0 1
 O    1.798200      2.2600001E-02  0.1593000    
 O   -4.311900       1.169500     -0.5501000    
 O   -4.462900      -1.098300     -0.5789000    
 C  -0.2270000      -1.221900     -8.3400004E-02
 C  -0.2709000       1.193500     -7.9000004E-02
 C   0.4435000     -1.8000000E-03  9.9999997E-05
 C   0.5204000      -2.512000     -9.9999997E-05
 C   0.4292000       2.509500      8.5000005E-03
 C   -1.612200      -1.246800     -0.2460000    
 C   -1.656100       1.168800     -0.2415000    
 C   0.6449000      -3.017500       1.443200    
 C   0.5354000       3.014600       1.453500    
 C   -2.326700     -5.1399998E-02 -0.3251000    
 C    2.588100      3.9099999E-02  -1.027100    
 C    1.377200      -4.347900       1.516900    
 C    1.278900       4.338100       1.538500    
 C    4.058700      4.3900002E-02 -0.6387000    
 C   -3.771000     -7.8400001E-02 -0.4937000    
 C    4.964400      7.6600000E-02  -1.856500    
 H   2.0999999E-03  -3.268700     -0.6047000    
 H    1.515400      -2.435900     -0.4478000    
 H    1.426400       2.468700     -0.4383000    
 H  -0.1131000       3.250700     -0.5942000    
 H   -2.129700      -2.201400     -0.3079000    
 H   -2.187100       2.115600     -0.2971000    
 H    1.180100      -2.280000       2.053600    
 H  -0.3511000      -3.133300       1.888300    
 H  -0.4665000       3.136600       1.882900    
 H    1.056600       2.274000       2.072500    
 H    2.369300     -0.8386000      -1.645300    
 H    2.358600      0.9269000      -1.626500    
 H   0.8479000      -5.118500      0.9476000    
 H    2.391600      -4.259000       1.115400    
 H    1.451200      -4.683300       2.556100    
 H    2.299600       4.239200       1.155500    
 H   0.7671000       5.112500      0.9584000    
 H    1.337100       4.674400       2.578300    
 H    4.281200     -0.8423000     -3.2299999E-02
 H    4.266300      0.9088000      2.6000000E-03
 H    4.799000     -0.7991000      -2.492100    
 H    6.014600      7.8900002E-02  -1.548200    
 H    4.784500      0.9751000      -2.455300    
 H   -5.285900       1.140300     -0.6633000    


%chk=000057883-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057883

0 1
O 1.771919 0.025603 0.126629
O -4.487951 1.169815 -0.727150
O -4.569804 -1.148909 -0.758483
C -0.297758 -1.251576 -0.172447
C -0.333115 1.244588 -0.160195
C 0.366778 0.005966 -0.093100
C 0.458719 -2.556620 0.011006
C 0.390099 2.566923 0.033812
C -1.696965 -1.246984 -0.357092
C -1.732831 1.206029 -0.344956
C 0.712525 -2.880735 1.511043
C 0.653361 2.877454 1.535066
C -2.417606 -0.030082 -0.450211
C 2.592641 0.036088 -1.115540
C 1.474640 -4.208883 1.699377
C 1.391994 4.217579 1.732265
C 4.062733 0.046452 -0.692730
C -3.884893 -0.100536 -0.654803
C 5.009037 0.062735 -1.913907
H -0.116633 -3.385649 -0.444665
H 1.438919 -2.520686 -0.500343
H 1.364871 2.563600 -0.489202
H -0.211659 3.386824 -0.404117
H -2.249287 -2.190647 -0.429476
H -2.302434 2.138358 -0.406618
H 1.285663 -2.047604 1.959635
H -0.259345 -2.924604 2.040402
H -0.313396 2.895715 2.075273
H 1.247418 2.050164 1.966629
H 2.354551 -0.862234 -1.722749
H 2.340260 0.934955 -1.716300
H 0.910566 -5.058716 1.270093
H 2.462104 -4.174538 1.200826
H 1.645144 -4.423626 2.770125
H 2.374872 4.207334 1.223774
H 0.808234 5.061979 1.318723
H 1.569199 4.422627 2.803833
H 4.258930 -0.843795 -0.066070
H 4.243125 0.932253 -0.055094
H 4.858510 -0.828109 -2.552115
H 6.064900 0.069937 -1.590628
H 4.842623 0.959178 -2.540232
H -5.465258 1.044175 -0.862190


