%chk=000060677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060677

0 1
 O    3.226700      -2.211000      0.9543000    
 O    1.139500      -2.336600       1.894100    
 N   -2.254700     -0.4362000     -3.7900001E-02
 N   0.4444000      0.8941000     -0.8032000    
 N   -2.042200      -3.163700     -0.8438000    
 C  -0.9311000      -1.102400      2.2900000E-02
 C   0.3441000     -0.3008000     -0.1247000    
 C  -0.9108000      -2.242600      -1.027000    
 C   -3.414300      -1.327600      6.6900000E-02
 C   -3.312200      -2.441900     -0.9747000    
 C   -2.404600      0.8952000      0.3533000    
 C  -0.6949000       1.581500      -1.384100    
 C    1.605700     -0.5974000      0.3558000    
 C   -1.669900       1.920100     -0.2871000    
 C    1.744000       1.362000     -0.7764000    
 C    2.493600      0.4332000     -4.8500001E-02
 C   -1.973600      -4.260700      -1.808900    
 C   -3.302300       1.278300       1.368400    
 C   -1.827300       3.261600      9.9799998E-02
 C    2.330300       2.519000      -1.315900    
 C    3.871700      0.6596000      0.1430000    
 C    1.933200      -1.764500       1.129600    
 C   -3.456200       2.615000       1.744900    
 C   -2.717900       3.606300       1.111300    
 C    3.698500       2.723000      -1.113200    
 C    4.460400       1.807600     -0.3947000    
 C    3.620100      -3.371000       1.696300    
 H  -0.9024000      -1.558300       1.020300    
 H  -0.9213000      -1.816800      -2.040800    
 H   2.5000000E-02  -2.808100     -0.9300000    
 H   -4.349100     -0.7849000     -0.1225000    
 H   -3.469700      -1.753500       1.076800    
 H   -4.152500      -3.130500     -0.8246000    
 H   -3.413900      -2.015400      -1.981900    
 H   -1.145000      0.9223000      -2.135500    
 H  -0.3558000       2.477700      -1.910800    
 H   -2.794900      -4.967500      -1.646200    
 H   -1.043900      -4.826400      -1.682500    
 H   -2.023600      -3.906000      -2.844700    
 H   -3.889500      0.5331000       1.900800    
 H   -1.253900       4.045700     -0.3886000    
 H    1.751200       3.244000      -1.877900    
 H    4.488700     -3.1599998E-02  0.7092000    
 H   -4.152100       2.877600       2.536500    
 H   -2.834700       4.645300       1.404300    
 H    4.172000       3.611500      -1.522900    
 H    5.521900       1.986700     -0.2467000    
 H    3.546900      -3.174100       2.769800    
 H    4.661000      -3.595600       1.449400    
 H    2.998600      -4.226400       1.415700    


%chk=000060677-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000060677

0 1
O 3.269310 -1.926351 1.457230
O 1.122463 -2.824628 1.317008
N -2.228242 -0.400516 -0.127161
N 0.432785 0.852900 -0.925049
N -2.105075 -3.142621 -1.032473
C -0.928289 -1.155900 -0.089804
C 0.339060 -0.339824 -0.214830
C -0.946060 -2.246644 -1.201401
C -3.369897 -1.327258 0.058720
C -3.373191 -2.390227 -1.052959
C -2.355025 0.913016 0.412082
C -0.741384 1.634194 -1.378493
C 1.629950 -0.687319 0.259053
C -1.632181 1.981648 -0.204959
C 1.764074 1.317218 -0.900324
C 2.546262 0.361042 -0.169302
C -2.083434 -4.285424 -1.961803
C -3.250303 1.220295 1.473272
C -1.783592 3.302516 0.262576
C 2.322985 2.484613 -1.462669
C 3.937346 0.589443 -0.010866
C 1.925555 -1.890303 1.030854
C -3.405524 2.550460 1.920384
C -2.668861 3.599163 1.325349
C 3.706930 2.689829 -1.290045
C 4.503032 1.751252 -0.572740
C 3.636980 -3.118701 2.252716
H -0.856804 -1.711760 0.869914
H -0.945534 -1.737578 -2.201300
H -0.023322 -2.843487 -1.106850
H -4.305545 -0.744210 0.007048
H -3.324004 -1.844069 1.044559
H -4.209342 -3.093953 -0.880365
H -3.546653 -1.881265 -2.037041
H -1.307168 1.020850 -2.105388
H -0.373716 2.537645 -1.888377
H -2.925157 -4.964149 -1.734290
H -1.144168 -4.850856 -1.829174
H -2.159976 -3.986642 -3.038222
H -3.809352 0.418339 1.965565
H -1.218026 4.109542 -0.219584
H 1.719911 3.209451 -2.019580
H 4.543827 -0.128524 0.545143
H -4.094199 2.764201 2.745835
H -2.784696 4.629194 1.678018
H 4.176110 3.584171 -1.714833
H 5.575988 1.940254 -0.456015
H 3.027824 -3.172647 3.170768
H 4.700918 -2.978186 2.492457
H 3.480607 -4.039291 1.665043


