%chk=000152199.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152199

0 1
 O   0.8100000      0.9786000      -1.085100    
 O   -1.322700     -0.5541000       1.354100    
 O   -2.706800       2.126200     -0.6209000    
 O   -4.630600       2.429500      0.5432000    
 N   0.7395000      -1.171100     -0.2307000    
 N    3.457300       1.040800      -1.037400    
 N   -2.751300     -0.4822000     -0.4826000    
 C  -0.5953000      -1.498800     -0.7142000    
 C    2.791900      0.1355000     -0.1005000    
 C  -0.6964000      -3.013400     -0.5758000    
 C    1.356000      -2.317500      0.4320000    
 C   0.2283000      -3.325100      0.5983000    
 C    2.955200      0.7630000       1.280900    
 C    1.363200      3.1599998E-02 -0.5237000    
 C    3.757300       2.032800       1.037900    
 C    4.471900       1.753900     -0.2676000    
 C   -1.573400     -0.7921000      0.1755000    
 C   -3.864100      0.1802000      0.1586000    
 C   -3.790100       1.682100      5.7900000E-02
 H  -0.7051000      -1.165600      -1.752000    
 H    3.305500     -0.8280000     -0.1497000    
 H  -0.3062000      -3.495400      -1.480600    
 H   -1.715200      -3.374800     -0.4068000    
 H    1.805100      -2.023500       1.384700    
 H    2.133400      -2.716100     -0.2289000    
 H  -0.2970000      -3.150900       1.544800    
 H   0.5851000      -4.358800      0.5960000    
 H    3.526300      8.6999997E-02   1.928500    
 H    2.007100      0.9861000       1.781600    
 H    3.078400       2.887600      0.9283000    
 H    4.448600       2.249300       1.857500    
 H    4.796300       2.670400     -0.7688000    
 H    5.348700       1.114800     -0.1129000    
 H    2.788000       1.731200      -1.381400    
 H   -2.851100     -0.7209000      -1.464900    
 H   -3.885500     -9.7099997E-02   1.216700    
 H   -4.775600     -0.1596000     -0.3408000    
 H   -2.681600       3.105400     -0.6726000    


%chk=000152199-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152199

0 1
O 0.710052 0.796386 -1.221537
O -2.536901 -1.644408 0.827952
O -3.877309 1.317085 -1.493373
O -4.553929 2.801130 0.161178
N 0.737816 -1.338396 -0.317869
N 3.425107 1.139399 -0.987776
N -1.772783 0.392897 -0.019146
C -0.649786 -1.654957 -0.790368
C 2.815121 0.035681 -0.204391
C -0.712738 -3.192813 -0.703293
C 1.383980 -2.516478 0.334957
C 0.222653 -3.526510 0.486262
C 2.951009 0.428900 1.330776
C 1.346507 -0.148673 -0.620700
C 3.384902 1.918091 1.300847
C 4.169739 2.008827 -0.036812
C -1.742518 -0.979091 0.092919
C -2.771515 1.187604 0.677877
C -3.813751 1.864952 -0.210836
H -0.759808 -1.266487 -1.819991
H 3.358269 -0.913218 -0.381308
H -0.335082 -3.640212 -1.640473
H -1.743924 -3.532922 -0.524004
H 1.834165 -2.234657 1.302252
H 2.183861 -2.918345 -0.318252
H -0.317541 -3.354144 1.433021
H 0.583097 -4.568214 0.472538
H 3.734130 -0.191277 1.804138
H 2.011858 0.276268 1.891578
H 2.499334 2.578861 1.261213
H 3.990732 2.197301 2.181220
H 4.245090 3.034592 -0.436957
H 5.199094 1.623138 0.101164
H 2.675032 1.652322 -1.480009
H -1.053406 0.833285 -0.622976
H -2.311280 1.983392 1.291234
H -3.313029 0.508996 1.366373
H -4.591144 1.782696 -2.008828


