%chk=000146059.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146059

0 1
 O    4.938200       1.079100     -0.8704000    
 O   -5.540000     -0.1041000      -1.068500    
 N   -1.627200      0.6968000       1.888200    
 C   0.6288000     -0.7785000      0.3528000    
 C    2.020100     -0.7129000     -0.2818000    
 C  -0.2070000      0.4411000     -0.1576000    
 C    2.766900      0.5787000      0.1064000    
 C   -1.666700      0.4499000      0.4340000    
 C   0.5544000       1.789600      5.5999998E-03
 C    2.007700       1.753200     -0.5008000    
 C  -8.9400001E-02  -2.088100      1.9999999E-04
 C    3.030100      -1.823400     -1.2900000E-02
 C    4.113200      0.2490000     -0.5125000    
 C   -2.312500     -0.9185000      0.1981000    
 C   -1.494300      -2.127700      0.5898000    
 C    4.327800      -1.252200     -0.6031000    
 C   -2.487400       1.572500     -0.2552000    
 C    3.013800      0.7866000       1.611800    
 C   -3.989600       1.426100     -7.1300000E-02
 C   -3.548500      -1.087400     -0.3007000    
 C   -4.438400      7.0299998E-02 -0.5519000    
 H   0.7344000     -0.7386000       1.442200    
 H    1.867800     -0.7140000      -1.375300    
 H  -0.3133000      0.3014000      -1.246300    
 H   0.5565000       2.097300       1.056500    
 H   3.0800000E-02   2.580100     -0.5440000    
 H    2.008000       1.680900      -1.596300    
 H    2.504900       2.701500     -0.2626000    
 H   0.4765000      -2.944700      0.3844000    
 H  -0.1442000      -2.206500      -1.089800    
 H    2.760500      -2.765700     -0.4999000    
 H    3.138200      -2.021000       1.059000    
 H   -1.430000      -2.174800       1.684000    
 H   -1.981800      -3.057500      0.2717000    
 H    4.437500      -1.530300      -1.655200    
 H    5.202000      -1.559500     -2.5200000E-02
 H   -2.275100       1.567300      -1.333900    
 H   -2.184100       2.561800      0.1101000    
 H    3.615500     -1.6300000E-02   2.051200    
 H    3.571600       1.716100       1.778700    
 H    2.088000      0.8549000       2.189000    
 H   -1.332900       1.653900       2.074700    
 H  -0.9437000      9.6100003E-02   2.343200    
 H   -4.503300       2.194200     -0.6597000    
 H   -4.282300       1.542200      0.9774000    
 H   -3.969400      -2.072600     -0.4713000    


%chk=000146059-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146059

0 1
O 5.030298 1.157456 -0.883769
O -5.689476 -0.037368 -0.951525
N -1.671642 0.704402 1.877818
C 0.635895 -0.806042 0.315756
C 2.051594 -0.739333 -0.288365
C -0.191873 0.408560 -0.218959
C 2.790509 0.585193 0.060859
C -1.651925 0.452069 0.411803
C 0.545991 1.770884 -0.060211
C 2.018504 1.766711 -0.558145
C -0.085176 -2.125782 -0.032623
C 3.092555 -1.851107 0.013501
C 4.197330 0.301411 -0.502737
C -2.328057 -0.918162 0.183834
C -1.519218 -2.148980 0.549564
C 4.417150 -1.229416 -0.514885
C -2.472421 1.581832 -0.272918
C 3.009051 0.803076 1.593071
C -3.986405 1.461468 -0.016552
C -3.607978 -1.035867 -0.287142
C -4.519134 0.112833 -0.484007
H 0.710655 -0.737478 1.423605
H 1.918099 -0.731117 -1.396252
H -0.328055 0.228040 -1.310312
H 0.524140 2.076892 1.005588
H -0.002747 2.552772 -0.617292
H 2.037845 1.673240 -1.662576
H 2.504628 2.729527 -0.312733
H 0.482523 -2.991260 0.359134
H -0.130645 -2.237438 -1.135331
H 2.853242 -2.804404 -0.488177
H 3.152343 -2.056526 1.098865
H -1.440321 -2.205104 1.658424
H -2.057661 -3.061313 0.234613
H 4.620943 -1.533272 -1.560200
H 5.316950 -1.495455 0.068297
H -2.277461 1.550254 -1.362753
H -2.116494 2.565056 0.088910
H 3.536375 -0.043135 2.068796
H 3.620019 1.710449 1.746769
H 2.050986 0.941168 2.121780
H -1.391575 1.650195 2.151852
H -1.250491 -0.021461 2.462891
H -4.556109 2.268237 -0.509284
H -4.169321 1.530628 1.075091
H -4.041337 -2.026034 -0.481273


