%chk=000088245.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088245

0 1
 O    2.033100      0.9611000     -6.0000003E-04
 O   -2.018100     -0.9401000      9.9999997E-05
 O   -2.117900       1.359700      3.0000001E-04
 N   0.7071000       1.376500     -3.9999999E-04
 C    2.077800     -0.3957000       0.000000    
 C  -8.5000005E-03  0.2481000      3.9999999E-04
 C   0.8038000     -0.8989000      7.9999998E-04
 C    3.412100      -1.008200     -1.9999999E-04
 C   -1.441400      0.3090000      6.9999998E-04
 C   -3.448000      -1.011500     -1.0000000E-03
 H   0.5166000      -1.940300      1.4000000E-03
 H    3.975900     -0.7029000      0.8866000    
 H    3.345400      -2.100700      1.9999999E-04
 H    3.975200     -0.7036000     -0.8878000    
 H   -3.848800     -0.5353000      0.8985000    
 H   -3.736800      -2.065700     -1.3000000E-03
 H   -3.847500     -0.5350000     -0.9010000    


%chk=000088245-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088245

0 1
O 2.086798 0.999067 -0.000196
O -2.017351 -0.949075 -0.000386
O -2.212147 1.380438 -0.000214
N 0.703059 1.450724 -0.000283
C 2.120067 -0.411175 -0.000027
C -0.014375 0.293332 -0.000142
C 0.819158 -0.880343 0.000007
C 3.471865 -1.044688 0.000080
C -1.500200 0.354955 -0.000152
C -3.498131 -1.035686 -0.000574
H 0.473139 -1.909033 0.000123
H 4.051454 -0.743507 0.890957
H 3.376152 -2.141853 0.000134
H 4.051548 -0.743600 -0.890768
H -3.908028 -0.545354 0.898220
H -3.715192 -2.112605 -0.000753
H -3.907816 -0.545099 -0.899325


