%chk=000037227.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037227

0 1
 O  -0.3761000      -1.501100      6.8200000E-02
 O    2.890800     -3.3900000E-02  0.1093000    
 O   -4.738000       1.795600     -7.1599998E-02
 O   -5.164900      -1.010000     -3.4699999E-02
 O    2.328000      -2.257000      0.1345000    
 N    6.530700      0.5608000      0.1874000    
 C   -1.299300      0.5607000      1.6700000E-02
 C   -1.549800     -0.8087000      3.3599999E-02
 C    5.111200      0.8779000      0.1374000    
 C   0.6246000     -0.5828000      7.3700003E-02
 C   0.1146000      0.6941000      4.3099999E-02
 C    4.276800     -0.3931000      0.1418000    
 C   -2.389700       1.448800     -1.9400001E-02
 C   -2.823500      -1.376400      1.7400000E-02
 C   -3.681700      0.9092000     -3.6300000E-02
 C   -3.891900     -0.4775000     -1.8100001E-02
 C    1.964700      -1.060800      0.1080000    
 C    7.334100       1.785300      0.2254000    
 C    6.918700     -0.2626000     -0.9605000    
 C   -5.989400       1.225000     -8.6599998E-02
 C   -6.190000     -9.3699999E-02 -6.9300003E-02
 H    4.856300       1.483100     -0.7433000    
 H    4.825400       1.480600       1.009300    
 H    4.473500     -0.9810000       1.046300    
 H    4.463000      -1.009700     -0.7427000    
 H   0.6816000       1.614900      3.9799999E-02
 H   -2.233600       2.523300     -3.3399999E-02
 H   -2.969900      -2.449900      3.1800002E-02
 H    7.068700       2.392200       1.098200    
 H    7.198600       2.396400     -0.6745000    
 H    8.398600       1.545300      0.3241000    
 H    8.009700     -0.3703000      -1.000300    
 H    6.593200      0.1682000      -1.914400    
 H    6.539500      -1.285600     -0.8758000    
 H   -6.772300       1.967300     -0.1138000    
 H   -7.158400     -0.5700000     -8.0499999E-02


%chk=000037227-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037227

0 1
O -0.428801 -1.605715 0.127682
O 2.897222 -0.091287 0.164619
O -4.790362 1.873390 -0.094007
O -5.283191 -1.004659 -0.026959
O 2.327757 -2.367221 0.242285
N 6.580053 0.579412 0.043289
C -1.334005 0.532864 0.041504
C -1.617284 -0.866335 0.073116
C 5.122107 0.818939 -0.049321
C 0.617316 -0.640931 0.129558
C 0.104365 0.649888 0.078524
C 4.338050 -0.468634 0.233297
C -2.418509 1.450669 -0.014942
C -2.913396 -1.404993 0.051527
C -3.716228 0.935106 -0.037077
C -3.964419 -0.479084 -0.004254
C 1.989199 -1.161976 0.185353
C 7.341354 1.812058 0.330805
C 7.129530 -0.146061 -1.121775
C -6.088077 1.300515 -0.116652
C -6.319571 -0.031851 -0.085808
H 4.813144 1.229087 -1.043405
H 4.841520 1.567833 0.713363
H 4.564798 -0.857782 1.241017
H 4.528687 -1.267742 -0.504270
H 0.704664 1.556192 0.070097
H -2.271917 2.533371 -0.041222
H -3.113849 -2.477728 0.076127
H 6.964883 2.276407 1.259257
H 7.284812 2.573860 -0.487865
H 8.405853 1.559667 0.484512
H 8.200309 -0.355787 -0.951708
H 7.035730 0.428829 -2.078399
H 6.618515 -1.114766 -1.253669
H -6.869286 2.056967 -0.161394
H -7.307172 -0.487902 -0.102407


