%chk=000037063.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037063

0 1
 O   -4.756900      -2.398700     -0.4111000    
 O    4.765900       2.393900     -0.4184000    
 O   -4.773700       2.390800     -0.4022000    
 O    4.762700      -2.395700     -0.3962000    
 O   -5.930400     -6.0999999E-03  -1.168100    
 O    5.928900     -5.5999998E-03  -1.169500    
 N  -1.9000000E-03  9.6000005E-03   1.095600    
 C   -1.193800      4.0000002E-03   1.928300    
 C    1.206300      1.2400000E-02   1.922300    
 C   -2.453800      1.2000001E-03   1.104200    
 C    2.453800      7.7999998E-03   1.105100    
 C   -3.041800       1.207900      0.7249000    
 C    3.036600      -1.202300      0.7288000    
 C   -3.033400      -1.208000      0.7203000    
 C    3.038200       1.213500      0.7175000    
 C   -4.201000      -1.210700     -4.2900000E-02
 C    4.205300       1.209100     -4.6500001E-02
 C   -4.209300       1.205300     -3.8400002E-02
 C    4.203600      -1.206800     -3.5300002E-02
 C   -4.788900     -3.8999999E-03 -0.4223000    
 C    4.787800     -1.0000000E-03 -0.4230000    
 C   -4.092800      -3.585600      1.8200001E-02
 C    4.107100       3.584700      8.1000002E-03
 C   -4.118000       3.580700      3.1500001E-02
 C    4.102300      -3.581600      4.1200001E-02
 C   -5.777100     -3.1000001E-03  -2.585400    
 C    5.774500     -1.1900000E-02  -2.586800    
 H   -1.198200     -0.8772000       2.583200    
 H   -1.205000      0.8766000       2.594900    
 H    1.210800      0.8881000       2.585100    
 H    1.209300     -0.8637000       2.584300    
 H  -4.9000001E-03  0.8441000      0.5082000    
 H   -2.544800       2.115600       1.050600    
 H    2.536600      -2.107500       1.056900    
 H   -2.530300      -2.113500       1.042500    
 H    2.539200       2.122200       1.037300    
 H   -4.671400      -4.433700     -0.3630000    
 H   -4.085300      -3.672200       1.110000    
 H   -3.089800      -3.666400     -0.4146000    
 H    3.104100       3.668500     -0.4243000    
 H    4.100700       3.674300       1.099700    
 H    4.688900       4.429300     -0.3757000    
 H   -4.111100       3.663200       1.123800    
 H   -3.115600       3.670100     -0.4008000    
 H   -4.702500       4.426100     -0.3464000    
 H    4.095900      -3.661100       1.133700    
 H    3.099200      -3.668000     -0.3903000    
 H    4.683000      -4.430500     -0.3349000    
 H   -6.772600     -5.2999998E-03  -3.037600    
 H   -5.240700     -0.8978000      -2.917100    
 H   -5.246100      0.8959000      -2.913800    
 H    6.769700     -1.5100000E-02  -3.039700    
 H    5.241600      0.8840000      -2.920500    
 H    5.239600     -0.9098000      -2.912300    


%chk=000037063-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037063

0 1
O -3.732981 -2.389956 -0.829549
O 6.061077 1.651747 0.181278
O -6.056609 1.651265 0.222619
O 3.722936 -2.377609 -0.883235
O -6.062133 -0.857231 -0.766739
O 6.055260 -0.850969 -0.824034
N 0.003733 0.838003 0.917378
C -1.236621 1.233428 1.616467
C 1.250212 1.233320 1.605512
C -2.485007 0.692979 0.926753
C 2.492634 0.695044 0.903392
C -3.666501 1.466432 0.903471
C 2.473769 -0.587426 0.312807
C -2.472452 -0.593464 0.344687
C 3.675284 1.466704 0.877019
C -3.647543 -1.111690 -0.246598
C 4.848536 0.954060 0.267271
C -4.844730 0.951983 0.304875
C 3.643905 -1.103689 -0.290016
C -4.850585 -0.348951 -0.276076
C 4.848168 -0.343137 -0.322054
C -2.554585 -3.251890 -0.729763
C 6.125094 2.964779 0.823993
C -6.113880 2.968553 0.857202
C 2.543276 -3.237754 -0.782806
C -6.100151 -1.184652 -2.206609
C 6.083381 -1.165858 -2.266894
H -1.171467 0.821543 2.646201
H -1.339863 2.341229 1.734404
H 1.353668 2.341026 1.724260
H 1.195096 0.819785 2.635192
H -0.000576 1.130698 -0.069403
H -3.659235 2.467827 1.345355
H 1.539604 -1.153973 0.344793
H -1.538979 -1.161324 0.373716
H 3.672771 2.465282 1.325292
H -2.852100 -4.199922 -1.202110
H -2.277727 -3.430192 0.327164
H -1.689120 -2.820186 -1.270660
H 5.416526 3.680343 0.361258
H 5.921391 2.893718 1.910490
H 7.156825 3.310065 0.662174
H -5.902980 2.904176 1.942743
H -5.407141 3.679759 0.385052
H -7.146049 3.314713 0.700108
H 2.272950 -3.424076 0.274431
H 1.675282 -2.799705 -1.314481
H 2.835613 -4.182530 -1.264804
H -7.129637 -1.526464 -2.393838
H -5.379602 -1.985700 -2.446561
H -5.888578 -0.283387 -2.814071
H 7.110074 -1.510957 -2.463214
H 5.872608 -0.258242 -2.865098
H 5.357656 -1.961426 -2.509643


