%chk=000085180.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085180

0 1
 O    2.130000      0.9459000       0.000000    
 O   -2.554700       1.914400     -3.0000001E-04
 O    2.373300      -1.343100      3.0000001E-04
 N   -1.904700      0.8192000      5.0000002E-04
 C   0.1986000     -0.3656000      3.9999999E-04
 C  -0.5231000      0.8235000      7.9999998E-04
 C  -0.4816000      -1.578600     -1.9999999E-04
 C   -1.872000      -1.594500     -6.0000003E-04
 C   -2.570200     -0.3914000     -3.9999999E-04
 C    1.651600     -0.3363000      6.0000003E-04
 C    3.552700       1.106600     -1.1000000E-03
 H  -9.8899998E-02   1.817800      1.2000001E-03
 H   5.4299999E-02  -2.524100     -5.0000002E-04
 H   -2.409700      -2.537300     -1.3000000E-03
 H   -3.648100     -0.3202000     -1.0000000E-03
 H    3.983300      0.6574000      0.8986000    
 H    3.774400       2.177000     -1.5000000E-03
 H    3.982000      0.6569000     -0.9013000    


%chk=000085180-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085180

0 1
O 2.166184 0.984403 -0.000603
O -2.667327 1.951507 0.000221
O 2.397842 -1.334939 -0.000701
N -1.966792 0.819881 0.000008
C 0.171346 -0.342996 -0.000562
C -0.573329 0.848443 -0.000320
C -0.482033 -1.602408 -0.000463
C -1.894184 -1.614654 -0.000146
C -2.618764 -0.417351 0.000082
C 1.666827 -0.315987 -0.000925
C 3.644911 1.103157 -0.000435
H -0.129766 1.843027 -0.000386
H 0.113187 -2.518381 -0.000646
H -2.449620 -2.556654 -0.000075
H -3.707126 -0.346733 0.000330
H 4.063927 0.621334 0.898566
H 3.837811 2.184334 -0.000241
H 4.064105 0.621618 -0.899505


