%chk=000135663.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135663

0 1
 O  -0.7158000       2.286800      -1.247600    
 O   -3.689100      -2.019200      0.5542000    
 O   -2.926300       1.757300      -1.417700    
 N   -2.058700     -0.3637000      0.3770000    
 N    1.373800      -1.575500     -0.5533000    
 C   -1.135000      -1.309700     -0.3211000    
 C   -1.660900       1.064300      0.5247000    
 C   0.2773000     -0.8689000     -0.1418000    
 C   0.7152000      0.2884000      0.4612000    
 C  -0.2302000       1.267200       1.054000    
 C    2.136500      0.2978000      0.4020000    
 C    2.523000     -0.8815000     -0.2422000    
 C   -1.500700      -1.454500      -1.800900    
 C   -3.315200     -0.8610000      0.7606000    
 C   -1.868400       1.725900     -0.8069000    
 C    3.136700       1.190800      0.8364000    
 C    3.863400      -1.208000     -0.4772000    
 C   -4.243000      9.2100002E-02   1.471600    
 C    4.480900      0.8763000      0.6072000    
 C    4.836400     -0.3049000     -4.0300000E-02
 H   -1.256200      -2.291400      0.1548000    
 H   -2.326100       1.589200       1.215900    
 H  -0.2440000       1.076300       2.136400    
 H   0.1252000       2.297300      0.9374000    
 H    1.348900      -2.469800      -1.023800    
 H   -1.335300     -0.5244000      -2.354700    
 H  -0.8924000      -2.229800      -2.279900    
 H   -2.552300      -1.732000      -1.926600    
 H    2.875100       2.115500       1.342800    
 H    4.141800      -2.128700     -0.9790000    
 H   -5.178900     -0.4231000       1.709600    
 H   -4.480700      0.9452000      0.8317000    
 H   -3.793000      0.4270000       2.409900    
 H    5.255500       1.562600      0.9392000    
 H    5.886800     -0.5296000     -0.2077000    
 H  -0.8297000       2.721600      -2.119400    


%chk=000135663-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135663

0 1
O -1.174673 3.120208 -0.690944
O -3.632977 -2.014220 0.684322
O -1.949427 1.361217 -1.988606
N -2.061503 -0.341040 0.343161
N 1.376690 -1.595101 -0.651691
C -1.143436 -1.394277 -0.216351
C -1.619534 1.058793 0.479849
C 0.278484 -0.911014 -0.110314
C 0.726992 0.231199 0.547232
C -0.243593 1.170063 1.207600
C 2.169726 0.269334 0.420595
C 2.551792 -0.894474 -0.341828
C -1.547488 -1.827708 -1.650980
C -3.326201 -0.782682 0.747950
C -1.599998 1.796518 -0.874444
C 3.180243 1.161571 0.865372
C 3.895879 -1.178897 -0.661700
C -4.328320 0.248944 1.265559
C 4.524512 0.881813 0.548464
C 4.878833 -0.275048 -0.206402
H -1.293222 -2.276497 0.440089
H -2.360753 1.598731 1.093475
H -0.397631 0.916523 2.275439
H 0.099478 2.218005 1.163122
H 1.324146 -2.447787 -1.204269
H -1.445306 -0.992998 -2.360476
H -0.918462 -2.675584 -1.985238
H -2.592390 -2.175929 -1.643531
H 2.921917 2.053019 1.448353
H 4.174090 -2.066372 -1.241185
H -5.274806 -0.282885 1.441143
H -4.508311 1.060158 0.537169
H -4.006147 0.702941 2.221390
H 5.315121 1.560923 0.886622
H 5.933251 -0.464985 -0.435830
H -1.182375 3.593436 -1.566615


