%chk=000154055.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154055

0 1
 O    2.716700      0.7352000      -1.040400    
 O   0.6966000      -1.171800       1.358300    
 O    2.524500      -2.653000     -7.4900001E-02
 O    4.804200      2.3200000E-02  0.8630000    
 O    1.898100       2.773400      0.3131000    
 O   -5.135000      -1.608700     -0.6060000    
 O   -5.608500      7.6899998E-02  0.7183000    
 N   0.5376000       1.169400     -0.2952000    
 N   0.7956000       2.515700     -0.1808000    
 N   -4.794900     -0.5769000      2.1700000E-02
 C    1.859600     -0.5257000      0.8495000    
 C    2.994400      -1.546700      0.6967000    
 C    1.538300      0.1414000     -0.4929000    
 C    4.191800     -0.9184000     -1.4200000E-02
 C    3.756700     -0.2099000      -1.297300    
 C  -0.8325000      0.7206000     -0.2136000    
 C   -1.201600     -0.4134000     -0.9045000    
 C   -1.722800       1.442200      0.5523000    
 C   -2.525100     -0.8467000     -0.8260000    
 C   -3.046400       1.008900      0.6309000    
 C   -3.447500     -0.1357000     -5.8100000E-02
 H    2.159600      0.2357000       1.580100    
 H    3.272700      -1.929400       1.685400    
 H    1.242500     -0.6053000      -1.229600    
 H    4.939800      -1.679900     -0.2591000    
 H    4.597200      0.3528000      -1.716600    
 H    3.417200     -0.9239000      -2.056100    
 H   0.9381000      -1.586200       2.204100    
 H    3.252900      -3.293900     -0.1406000    
 H    4.229800      0.8053000      0.9212000    
 H  -0.5595000     -0.9872000      -1.558700    
 H   -1.437100       2.327000       1.113000    
 H   -2.805700      -1.736300      -1.384400    
 H   -3.736700       1.585600       1.241400    


%chk=000154055-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154055

0 1
O 2.208044 0.148852 -1.266940
O 1.445005 -1.447874 2.080225
O 3.259487 -2.679622 0.552394
O 4.672497 0.801621 0.124423
O 2.069651 2.272973 0.647156
O -5.541172 -0.886857 -1.458952
O -5.964180 0.618791 0.203745
N 0.450055 0.755589 0.148663
N 0.812753 2.069655 0.509899
N -5.158096 -0.047402 -0.554280
C 2.261941 -0.602848 1.218938
C 3.613308 -1.281112 0.906774
C 1.448565 -0.308914 -0.095733
C 4.338858 -0.566969 -0.262819
C 3.453297 -0.612989 -1.514660
C -0.954438 0.547799 -0.027245
C -1.422045 -0.340207 -1.031576
C -1.874523 1.255132 0.791309
C -2.801952 -0.539893 -1.204001
C -3.254722 1.065324 0.615316
C -3.703127 0.164489 -0.376327
H 2.449700 0.320802 1.780185
H 4.244777 -1.257786 1.815017
H 0.899525 -1.239994 -0.336699
H 5.308090 -1.057149 -0.463714
H 3.928815 -0.087434 -2.356585
H 3.216077 -1.659325 -1.790027
H 1.625771 -2.387048 1.794119
H 4.029914 -3.276991 0.711045
H 3.842607 1.360382 0.111978
H -0.716506 -0.842987 -1.699153
H -1.499667 1.931353 1.562545
H -3.191450 -1.212894 -1.971862
H -3.986257 1.587831 1.236841


