%chk=000088085.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088085

0 1
 O    3.689700      0.6804000     -2.6000000E-03
 O    3.272500      -1.479200      9.9999997E-05
 N    2.888900     -0.2849000     -7.9999998E-04
 N   -3.577800     -0.1809000     -1.0000000E-03
 N   -4.353700      -1.017300     -1.6000000E-03
 C   -1.244200      0.5133000      1.1000000E-03
 C    1.494900     -1.5799999E-02  8.9999998E-04
 C  -0.3303000       1.567100      8.9999998E-04
 C  -0.7885000     -0.8051000      1.3000000E-03
 C    1.039200       1.302500      6.0000003E-04
 C   0.5811000      -1.069600      1.3000000E-03
 C   -2.671900      0.7897000     -3.0000001E-04
 H  -0.6716000       2.599100      3.9999999E-04
 H   -1.471100      -1.650100      1.3000000E-03
 H    1.721500       2.148700       0.000000    
 H   0.8996000      -2.109000      1.2000001E-03
 H   -3.024000       1.833800     -1.0000000E-03


%chk=000088085-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088085

0 1
O 3.750532 0.733900 -0.000396
O 3.339071 -1.514378 0.000391
N 2.945075 -0.280534 0.000402
N -3.636386 -0.131096 -0.000074
N -4.468657 -0.973581 0.000268
C -1.280068 0.492291 0.000094
C 1.496375 -0.015070 0.000297
C -0.341461 1.570648 -0.000072
C -0.785191 -0.849514 0.000318
C 1.038629 1.323259 0.000018
C 0.593210 -1.104345 0.000459
C -2.700438 0.808379 -0.000118
H -0.705522 2.604039 -0.000316
H -1.484255 -1.693206 0.000366
H 1.768893 2.136595 -0.000148
H 0.989235 -2.123228 0.000633
H -3.064741 1.838541 -0.000321


