%chk=000025530.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025530

0 1
 O   -2.578300       2.305500      0.6468000    
 O   -2.576300      -2.317600      0.6402000    
 O    2.813500       2.674400     -7.4199997E-02
 O    2.820700      -2.671600     -8.2099997E-02
 O   -7.334900     -8.2000000E-03  -1.482800    
 N   -2.986000     -7.1000000E-03  0.7033000    
 N   0.2421000       2.827100      0.2703000    
 N   0.2497000      -2.832400      0.2622000    
 C  -0.8502000      0.6883000      0.4155000    
 C  -0.8482000     -0.6970000      0.4136000    
 C    1.504500      0.7050000      9.9299997E-02
 C    1.506600     -0.7064000      9.7700000E-02
 C   0.3084000       1.421500      0.2605000    
 C   0.3124000      -1.426700      0.2569000    
 C   -2.229100       1.140500      0.6000000    
 C   -2.225700      -1.152700      0.5964000    
 C   -4.421900     -9.3999999E-03  0.9023000    
 C    2.769300       1.450400     -7.0000000E-02
 C    2.773600      -1.447800     -7.2700001E-02
 C   -5.192900     -8.3999997E-03 -0.4111000    
 C    4.030600      0.7012000     -0.2391000    
 C    4.032600     -0.6947000     -0.2403000    
 C   -6.703200      9.2000002E-03 -0.2095000    
 C    5.232900       1.401100     -0.3992000    
 C    5.237100      -1.390700     -0.4012000    
 C    6.430500      0.7037000     -0.5592000    
 C    6.432600     -0.6895000     -0.5602000    
 C   -8.750400      3.2000002E-02  -1.363400    
 H   -4.689800      0.8777000       1.487500    
 H   -4.688600     -0.8981000       1.485600    
 H   -4.899500      0.8566000      -1.020000    
 H   -4.916700     -0.8860000      -1.009900    
 H    1.075400       3.386800      0.1595000    
 H  -0.6475000       3.292800      0.3907000    
 H    1.084600      -3.389600      0.1513000    
 H  -0.6385000      -3.300700      0.3824000    
 H   -7.015800     -0.8697000      0.3662000    
 H   -6.997500      0.9135000      0.3359000    
 H    5.261200       2.487500     -0.4023000    
 H    5.268700      -2.476900     -0.4060000    
 H    7.362500       1.247700     -0.6832000    
 H    7.366200      -1.230500     -0.6849000    
 H   -9.181300      1.3000000E-02  -2.368000    
 H   -9.067400      0.9532000     -0.8650000    
 H   -9.113700     -0.8400000     -0.8110000    


%chk=000025530-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025530

0 1
O -2.662728 2.363551 0.714625
O -2.664818 -2.360022 0.705833
O 2.861417 2.762753 -0.077784
O 2.859853 -2.761264 -0.081151
O -7.391893 0.007773 -1.518913
N -3.037243 0.001850 0.754886
N 0.278078 2.836686 0.292588
N 0.275409 -2.834212 0.281170
C -0.845474 0.699970 0.443399
C -0.846075 -0.697062 0.440903
C 1.572460 0.722982 0.103869
C 1.571830 -0.720985 0.101350
C 0.338897 1.472379 0.279292
C 0.337607 -1.469919 0.273979
C -2.238198 1.173534 0.642230
C -2.239231 -1.170141 0.637820
C -4.495409 0.002106 0.939358
C 2.834286 1.470504 -0.071580
C 2.832975 -1.469006 -0.076806
C -5.256016 0.005958 -0.406225
C 4.097158 0.712061 -0.252777
C 4.096599 -0.711045 -0.254746
C -6.773084 0.008075 -0.192090
C 5.316334 1.415918 -0.424943
C 5.315262 -1.415395 -0.428499
C 6.521749 0.710108 -0.596767
C 6.521218 -0.710077 -0.598521
C -8.851493 0.012297 -1.449748
H -4.751020 0.899769 1.531592
H -4.751780 -0.898457 1.526819
H -4.976740 0.899177 -0.993543
H -4.980072 -0.886133 -0.996837
H 1.167584 3.343048 0.168739
H -0.632091 3.286579 0.422684
H 1.163923 -3.340957 0.152084
H -0.635178 -3.283755 0.409562
H -7.093319 -0.892891 0.381139
H -7.091040 0.910726 0.379706
H 5.286126 2.509515 -0.419213
H 5.284169 -2.508978 -0.425814
H 7.461964 1.255844 -0.729418
H 7.461010 -1.256188 -0.732604
H -9.210196 0.012117 -2.490845
H -9.232487 0.917220 -0.929096
H -9.238020 -0.889013 -0.926905


