%chk=000057880.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057880

0 1
 O  -0.1573000       2.403700      0.7557000    
 O    1.459300      -3.557300     -0.2465000    
 O  -0.7898000      -3.885000     -0.2761000    
 C   -1.241500      0.3005000      0.4225000    
 C    1.170200      0.4454000      0.4209000    
 C   -2.585400      0.9399000      0.5420000    
 C    2.428000       1.241400      0.5395000    
 C  -7.6800004E-02   1.059800      0.5355000    
 C   -3.121600       1.420100     -0.8131000    
 C    2.901600       1.782000     -0.8161000    
 C   -1.159200      -1.073300      0.1943000    
 C    1.252500     -0.9284000      0.1929000    
 C   8.7800004E-02  -1.687800      7.9300001E-02
 C   -4.504600       2.039500     -0.6887000    
 C    4.163600       2.619600     -0.6829000    
 C   0.1732000      -3.120000     -0.1592000    
 H   -3.290700      0.2091000      0.9620000    
 H   -2.580500       1.755700       1.274900    
 H    3.217700      0.6193000      0.9815000    
 H    2.290400       2.068900       1.247000    
 H   -2.438100       2.156900      -1.251700    
 H   -3.170200      0.5794000      -1.516100    
 H    2.114500       2.394700      -1.272200    
 H    3.093500      0.9503000      -1.505000    
 H   -2.070700      -1.659800      0.1042000    
 H    2.237700      -1.379500      0.1054000    
 H   -5.223800       1.315900     -0.2919000    
 H   -4.486000       2.907400     -2.2000000E-02
 H   -4.861500       2.371000      -1.668900    
 H    3.993700       3.483000     -3.1800002E-02
 H    4.983400       2.028100     -0.2632000    
 H    4.478600       2.989800      -1.663500    
 H   -1.026400       2.746300      0.4966000    
 H    1.506000      -4.523800     -0.4080000    


%chk=000057880-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057880

0 1
O -0.100527 2.335517 0.691342
O 1.490286 -3.801042 -0.097720
O -0.814645 -4.075542 -0.111582
C -1.268979 0.175456 0.421986
C 1.225078 0.353220 0.423067
C -2.632635 0.848343 0.480747
C 2.473100 1.213707 0.495187
C -0.068252 0.940955 0.509458
C -3.036769 1.540688 -0.854673
C 2.785726 1.935514 -0.846835
C -1.147987 -1.216481 0.247000
C 1.297317 -1.042652 0.245435
C 0.124030 -1.835475 0.154684
C -4.407325 2.242921 -0.759806
C 4.056403 2.806045 -0.756595
C 0.174204 -3.302818 -0.025341
H -3.399964 0.092031 0.728577
H -2.683582 1.594442 1.306238
H 3.339128 0.583389 0.774741
H 2.354108 1.983493 1.281049
H -2.259655 2.270947 -1.158168
H -3.060507 0.774516 -1.652640
H 1.918595 2.564275 -1.123341
H 2.902838 1.178152 -1.646843
H -2.042644 -1.845727 0.179896
H 2.274676 -1.530324 0.179659
H -5.203998 1.523243 -0.493590
H -4.401935 3.036430 0.011884
H -4.684207 2.710591 -1.721724
H 3.945600 3.589700 0.016501
H 4.941314 2.196052 -0.492911
H 4.267222 3.308034 -1.718668
H -1.030831 2.652403 0.807105
H 1.442418 -4.787202 -0.216820


