%chk=000132359.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132359

1 1
 O   -3.138000      9.4200000E-02  -1.477100    
 O   -3.441500       2.362800      -1.163900    
 O    2.538800       1.964700       2.455100    
 N   0.1607000       2.618200      0.7179000    
 N    5.105100      -2.781800     -0.9378000    
 N    6.344000      -2.741900     -0.7732000    
 N    7.475500      -2.711500     -0.6265000    
 C  -0.4132000       1.199900      0.7490000    
 C  -0.6615000       3.508900     -0.2155000    
 C   -1.253100       1.473400      -1.642800    
 C  -0.5068000      0.5910000     -0.6460000    
 C  -0.7714000       2.921600      -1.619100    
 C    1.637800       2.614600      0.3262000    
 C   6.7400001E-02   3.199500       2.135100    
 C   -4.712500      -1.054800     -6.0699999E-02
 C   -2.732400       1.393400      -1.397600    
 C   -3.963100      -2.375800     -0.2803000    
 C   -6.201100      -1.309800      0.2121000    
 C   -4.535300     -0.1279000      -1.261900    
 C   -4.169000      -3.341200      0.8849000    
 C   -6.403200      -2.276900       1.376500    
 C    2.443700       1.732900       1.252200    
 C   -5.649800      -3.585400       1.158600    
 C    3.142800      0.5474000      0.6770000    
 C    3.590600      0.5746000     -0.6438000    
 C    3.348800     -0.5886000       1.459900    
 C    4.244100     -0.5340000      -1.181700    
 C    4.002400      -1.697200      0.9221000    
 C    4.450000      -1.670000     -0.3987000    
 H   -1.414900       1.277300       1.190300    
 H   0.1923000      0.5785000       1.416100    
 H  -0.1812000       4.493900     -0.2390000    
 H   -1.654900       3.621800      0.2325000    
 H   -1.096200       1.086000      -2.658400    
 H  -0.9624000     -0.4022000     -0.5615000    
 H   0.5022000      0.4084000      -1.032700    
 H   0.2040000       2.978100      -2.116700    
 H   -1.435600       3.558800      -2.216700    
 H    2.015300       3.642000      0.3848000    
 H    1.691700       2.299100     -0.7127000    
 H  -0.9777000       3.467900       2.323600    
 H   0.6909000       4.096100       2.198100    
 H   0.3494000       2.444900       2.872100    
 H   -4.270100     -0.5647000      0.8177000    
 H   -2.888300      -2.195300     -0.3972000    
 H   -4.308000      -2.851700      -1.207300    
 H   -6.680200      -1.721300     -0.6856000    
 H   -6.707400     -0.3636000      0.4372000    
 H   -5.101500      0.7978000      -1.110900    
 H   -4.929500     -0.5988000      -2.170000    
 H   -3.673200      -4.293700      0.6662000    
 H   -3.693600      -2.932800       1.785100    
 H   -6.057200      -1.806500       2.305100    
 H   -7.472000      -2.483600       1.502300    
 H   -5.761200      -4.226600       2.040300    
 H   -6.093000      -4.125000      0.3127000    
 H    3.487700       1.451800      -1.274300    
 H    3.002000     -0.6291000       2.489200    
 H    4.596400     -0.5004000      -2.209500    
 H    4.156100      -2.578200       1.539800    


%chk=000132359-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132359

1 1
O -3.871523 0.062704 -1.682913
O -3.299859 1.675422 -0.097076
O 2.222409 0.176972 2.022897
N 0.302650 1.793093 0.615184
N 8.009374 -0.154212 -0.885814
N 8.868807 -0.864421 -0.267921
N 9.809952 -1.461908 0.122144
C -0.483202 0.462339 0.794426
C -0.481550 2.697950 -0.373894
C -1.556173 0.662074 -1.533638
C -0.765066 -0.240812 -0.540252
C -0.806060 2.010202 -1.710912
C 1.720470 1.584376 0.075684
C 0.354894 2.514356 1.965145
C -5.610669 -0.792635 -0.062781
C -2.984579 0.874655 -1.020576
C -5.291885 -2.280625 -0.355251
C -7.100444 -0.625301 0.349298
C -5.323648 0.121825 -1.261361
C -5.638650 -3.180440 0.854904
C -7.454120 -1.528329 1.555365
C 2.650648 0.696521 0.944528
C -7.118426 -3.011631 1.273510
C 4.026528 0.492840 0.453354
C 4.526146 1.068950 -0.755006
C 4.899048 -0.324323 1.234366
C 5.843075 0.836155 -1.168144
C 6.217133 -0.564430 0.832484
C 6.699032 0.017410 -0.378437
H -1.428387 0.756672 1.281468
H 0.111666 -0.156067 1.481729
H 0.124395 3.609175 -0.519059
H -1.423602 2.952275 0.137823
H -1.627062 0.146106 -2.505266
H -1.337940 -1.158592 -0.313524
H 0.172234 -0.580117 -1.020288
H 0.105855 1.839197 -2.313270
H -1.423390 2.721303 -2.289650
H 2.163801 2.590744 -0.034335
H 1.636854 1.148273 -0.932559
H -0.677706 2.720413 2.284680
H 0.902615 3.462349 1.841629
H 0.862446 1.866090 2.691704
H -4.987992 -0.453239 0.792063
H -4.225679 -2.398963 -0.632077
H -5.885776 -2.608727 -1.234332
H -7.749380 -0.894759 -0.510265
H -7.311727 0.434090 0.595640
H -5.563634 1.175632 -1.033211
H -5.853050 -0.211307 -2.169008
H -5.428737 -4.238628 0.608635
H -4.984327 -2.915492 1.711821
H -6.887419 -1.186293 2.445797
H -8.527433 -1.418180 1.799698
H -7.336004 -3.626921 2.166797
H -7.772279 -3.386923 0.459699
H 3.895630 1.705750 -1.385007
H 4.510948 -0.760759 2.160174
H 6.237743 1.271266 -2.090356
H 6.872726 -1.193945 1.444137


