%chk=000129224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129224

0 1
 O   -3.089500      0.8742000      -1.370700    
 O   -5.555200      0.1117000      -2.486200    
 O    1.511800      0.2020000     -0.4134000    
 O    1.706400       3.621700       1.792700    
 N   -4.786600      -1.322300      0.8394000    
 C   -5.360800      0.1497000      -1.069500    
 C   -4.947700      -1.249400     -0.6064000    
 C   -4.449100      -2.675900       1.258500    
 C   -4.323900       1.223300     -0.7467000    
 C   -5.558200      -3.645200      0.8595000    
 C   -4.218200      -2.697900       2.766100    
 C   -1.946900       1.295600     -0.7620000    
 C   0.3928000      0.9802000     -0.2581000    
 C   0.3891000       2.160100      0.4841000    
 C  -0.7764000      0.5461000     -0.8831000    
 C    2.687000      0.6047000      0.2025000    
 C   -1.948700       2.476600     -1.8400000E-02
 C  -0.7806000       2.913500      0.6076000    
 C    1.636300       2.595400       1.130900    
 C    3.829000     -0.3012000     -3.3700000E-02
 C    2.811300       1.721900      0.9364000    
 C    5.130400      0.2056000     -7.4600004E-02
 C    3.613400      -1.669200     -0.2173000    
 C    5.989800      -2.015600     -0.4809000    
 C    6.209000     -0.6502000     -0.2978000    
 C    4.692000      -2.525000     -0.4406000    
 C    7.143400      -2.930400     -0.7184000    
 H   -6.319100      0.4324000     -0.6175000    
 H   -4.025100      -1.554300      -1.116700    
 H   -5.731000      -1.925900     -0.9644000    
 H   -3.512100      -2.988900      0.7809000    
 H   -5.645900      -1.017500       1.296300    
 H   -4.231100       1.307500      0.3431000    
 H   -4.652400       2.184100      -1.160400    
 H   -5.415200      -4.610400       1.360100    
 H   -6.549200      -3.276800       1.148400    
 H   -5.561600      -3.860600     -0.2136000    
 H   -3.418600      -2.004700       3.050800    
 H   -3.921900      -3.698700       3.098500    
 H   -5.122900      -2.415600       3.316500    
 H  -0.7784000     -0.3737000      -1.462500    
 H   -6.265400     -0.5270000      -2.668500    
 H   -2.831800       3.102100      7.4299999E-02
 H  -0.7988000       3.838600       1.176800    
 H    3.727800       2.027900       1.427000    
 H    5.341100       1.265400      4.1099999E-02
 H    2.613400      -2.094600     -0.1829000    
 H    7.215100     -0.2408000     -0.3334000    
 H    4.508500      -3.586900     -0.5816000    
 H    8.045400      -2.567900     -0.2139000    
 H    6.939600      -3.933300     -0.3280000    
 H    7.347700      -3.006600      -1.790900    


%chk=000129224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129224

0 1
O -2.967085 0.310630 -0.832188
O -5.172550 0.085987 -2.738527
O 1.752136 0.147018 -0.273890
O 1.921707 3.866680 1.638699
N -5.638558 -1.370499 0.720766
C -5.347190 0.065593 -1.278838
C -5.294181 -1.373651 -0.711653
C -5.054450 -2.448338 1.563727
C -4.275364 0.976173 -0.687345
C -5.517383 -3.877073 1.166018
C -5.375133 -2.150977 3.042344
C -1.839074 0.970401 -0.352898
C 0.565120 0.879685 -0.068592
C 0.578155 2.146840 0.575971
C -0.617095 0.283506 -0.533924
C 2.979204 0.679149 0.163759
C -1.863039 2.247448 0.285876
C -0.661713 2.813155 0.738485
C 1.855210 2.732646 1.051755
C 4.111071 -0.220062 -0.142392
C 3.036875 1.905815 0.792538
C 5.433404 0.090212 0.280659
C 3.903629 -1.423426 -0.870874
C 6.303705 -1.970821 -0.754156
C 6.504184 -0.770745 -0.020579
C 4.982299 -2.279467 -1.167335
C 7.469466 -2.877589 -1.101566
H -6.331032 0.517225 -1.010464
H -4.264493 -1.753036 -0.831193
H -5.959928 -2.021693 -1.337107
H -3.956129 -2.387178 1.425071
H -6.649742 -1.269542 0.886713
H -4.494878 1.130736 0.386211
H -4.267267 1.939798 -1.231646
H -4.997220 -4.643967 1.769886
H -6.606313 -3.993911 1.331041
H -5.305595 -4.084408 0.100947
H -4.999309 -1.153081 3.326444
H -4.914337 -2.905280 3.704832
H -6.468972 -2.172773 3.219418
H -0.600121 -0.689297 -1.030263
H -5.724668 -0.632228 -3.140394
H -2.803789 2.785556 0.426088
H -0.644238 3.790046 1.233083
H 3.997806 2.308581 1.119134
H 5.630952 1.001343 0.854265
H 2.892504 -1.677909 -1.198886
H 7.513751 -0.511694 0.320252
H 4.796916 -3.202889 -1.729029
H 8.247311 -2.855959 -0.318095
H 7.144392 -3.924078 -1.234997
H 7.949054 -2.558849 -2.047749


