%chk=000226570.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226570

0 1
 O    4.481400     -8.9100003E-02 -9.4999997E-03
 O   -1.495200      -2.505600      5.5799998E-02
 N   -1.112500     -0.1824000      6.0000001E-03
 N   -1.675600       1.070400      2.3900000E-02
 C   0.3309000     -0.1583000      2.4999999E-03
 C    1.048600      -1.354400     -2.0999999E-03
 C    1.008500       1.061200      3.7000000E-03
 C   -1.892600      -1.342600      4.9999999E-03
 C   -2.962200       1.183900      1.8000000E-03
 C    3.120700     -0.1117000     -4.4999998E-03
 C    2.443300      -1.331200     -5.5999998E-03
 C    2.403300       1.084400      9.9999997E-05
 C   -3.362400      -1.152600     -4.5899998E-02
 C   -3.903400      6.0600001E-02 -4.8099998E-02
 C   -3.542400       2.575400      2.4900001E-02
 C    5.109600       1.192000     -8.0000004E-03
 H   0.6120000      -2.341300     -9.2000002E-03
 H   0.4947000       2.018400      6.5000001E-03
 H    2.998400      -2.265500     -1.0700000E-02
 H    2.865900       2.065600      6.9999998E-04
 H   -3.986100      -2.039300     -7.5300001E-02
 H   -4.971400      0.2258000     -8.1200004E-02
 H   -3.192500       3.126200     -0.8532000    
 H   -3.203800       3.092500      0.9277000    
 H   -4.635200       2.557600      1.8200001E-02
 H    4.877700       1.752900      0.9038000    
 H    4.872100       1.757800     -0.9153000    
 H    6.191200       1.021600     -1.1900000E-02


%chk=000226570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226570

0 1
O 4.534575 -0.098665 0.001787
O -1.434990 -2.589405 -0.037223
N -1.163587 -0.205256 -0.008965
N -1.727621 1.063041 0.003871
C 0.293205 -0.187312 -0.006877
C 1.072417 -1.380499 -0.007414
C 0.958845 1.065929 -0.003480
C -1.950607 -1.427617 -0.023974
C -3.059567 1.201632 0.002321
C 3.133996 -0.051152 -0.000873
C 2.475406 -1.303136 -0.004298
C 2.364488 1.139944 -0.000618
C -3.391235 -1.201736 -0.024922
C -3.941499 0.064012 -0.012136
C -3.577714 2.626074 0.014214
C 5.256529 1.176474 0.005359
H 0.578037 -2.350866 -0.011153
H 0.363099 1.979440 -0.002756
H 3.079519 -2.215234 -0.004621
H 2.841324 2.124548 0.001801
H -4.001336 -2.109015 -0.036328
H -5.025295 0.215542 -0.012793
H -3.246632 3.173999 -0.885590
H -3.199033 3.176413 0.893140
H -4.679706 2.641650 0.042833
H 5.022382 1.768939 0.911040
H 5.026237 1.771788 -0.899440
H 6.321764 0.902768 0.007196


