%chk=000089169.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089169

1 1
 O    2.718800      0.5821000      0.4213000    
 O    1.522400      -1.283600     -0.2209000    
 N  -0.8089000      0.3741000     -0.2967000    
 C   -1.201000      -1.107900     -0.1253000    
 C   -2.041600       1.188100      0.1471000    
 C   -2.703700      -1.087100      7.3200002E-02
 C   -2.926900      0.1854000      0.8603000    
 C   0.3930000      0.7070000      0.5741000    
 C  -0.4729000      0.6735000      -1.749600    
 C    1.578900     -0.1381000      0.2050000    
 C    3.942000     -9.3500003E-02  0.1116000    
 H  -0.7245000      -1.497300      0.7813000    
 H  -0.8963000      -1.685000      -1.003600    
 H   -2.535000       1.577100     -0.7506000    
 H   -1.726600       2.021100      0.7830000    
 H   -3.063000      -1.974800      0.6014000    
 H   -3.216600      -1.035300     -0.8945000    
 H   -3.976000      0.4943000      0.8685000    
 H   -2.600500      5.7599999E-02   1.899200    
 H   0.6125000       1.769300      0.4193000    
 H   0.1233000      0.5301000       1.620700    
 H   0.3612000      4.8999999E-02  -2.077700    
 H   -1.354800      0.4491000      -2.358000    
 H  -0.2179000       1.734200      -1.831900    
 H    4.049800     -0.9861000      0.7351000    
 H    4.770100      0.5869000      0.3266000    
 H    3.970500     -0.3571000     -0.9499000    


%chk=000089169-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089169

1 1
O 2.735160 0.414677 0.668122
O 1.695502 -0.921616 -0.940326
N -0.836706 0.397021 -0.388615
C -1.169950 -1.107730 -0.095954
C -2.051358 1.206823 0.203185
C -2.682271 -1.129761 0.162596
C -2.914605 0.177944 0.955491
C 0.449899 0.836868 0.304992
C -0.744090 0.637642 -1.897703
C 1.674379 -0.008972 -0.084298
C 4.054330 -0.258516 0.434540
H -0.609818 -1.393177 0.809933
H -0.810314 -1.712816 -0.938890
H -2.590825 1.637817 -0.654757
H -1.659594 2.024369 0.827697
H -2.972284 -2.028731 0.729479
H -3.255559 -1.133035 -0.782051
H -3.971720 0.487625 0.972160
H -2.582925 0.063959 2.003073
H 0.642503 1.893523 0.049234
H 0.297141 0.774200 1.395488
H 0.110097 0.072270 -2.295404
H -1.678011 0.289127 -2.363878
H -0.618413 1.716713 -2.080273
H 3.959291 -1.336085 0.640777
H 4.736061 0.229122 1.142270
H 4.370379 -0.096162 -0.607887


