%chk=000037932.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037932

0 1
 O   -1.135900      2.5699999E-02 -0.1011000    
 O  -0.1803000       2.087700     -0.3563000    
 O    5.812700     -0.7439000     -0.5946000    
 N   -5.916300      -1.908300     -0.8038000    
 N    1.099200      0.1283000     -0.2919000    
 C   -4.874200      0.1210000      0.1770000    
 C   -5.949700     -0.9791000      0.3280000    
 C   -4.976900       1.138200       1.326300    
 C   -7.354800     -0.3709000      0.4485000    
 C   -6.378600       1.729400       1.442000    
 C   -7.434700      0.6406000       1.588200    
 C   -3.456500     -0.4589000      0.1304000    
 C   -2.419700      0.6324000     -4.8099998E-02
 C   -6.843700      -3.015800     -0.5805000    
 C   -6.241400      -1.209500      -2.045800    
 C  -6.4599998E-02  0.8718000     -0.2614000    
 C    2.425700      0.5934000     -0.4399000    
 C    3.468700     -0.3190000     -0.4442000    
 C    2.657500       1.953000     -0.5763000    
 C    4.778000      0.1401000     -0.5887000    
 C    7.829100      -1.459400      0.4911000    
 C    7.066200     -0.2799000     -9.5200002E-02
 C    9.178500      -1.030900       1.060500    
 C    3.966600       2.412100     -0.7207000    
 C    5.026900       1.505700     -0.7270000    
 C    9.918200      -2.203800       1.683500    
 H   -5.041300      0.7057000     -0.7346000    
 H   -5.725900      -1.533300       1.250700    
 H   -4.702000      0.6630000       2.276400    
 H   -4.298700       1.983700       1.177800    
 H   -7.660400      0.1705000     -0.4521000    
 H   -8.116300      -1.131500      0.6483000    
 H   -6.424100       2.403700       2.304800    
 H   -6.596300       2.334000      0.5527000    
 H   -8.431700       1.095300       1.611200    
 H   -7.298000      0.1241000       2.546300    
 H   -3.354000      -1.175400     -0.6936000    
 H   -3.239500      -1.026300       1.044700    
 H   -2.411500       1.325300      0.7971000    
 H   -2.602100       1.186600     -0.9760000    
 H   -6.646900      -3.803100      -1.318100    
 H   -6.688700      -3.476400      0.4018000    
 H   -7.899800      -2.745700     -0.6834000    
 H   -7.272300     -0.8525000      -2.124500    
 H   -5.552600     -0.4006000      -2.298200    
 H   -6.120700      -1.921400      -2.873800    
 H   0.9908000     -0.8786000     -0.1959000    
 H    3.279800      -1.384000     -0.3363000    
 H    1.890200       2.713300     -0.5825000    
 H    7.220200      -1.931200       1.272800    
 H    7.968300      -2.224700     -0.2826000    
 H    7.635900      0.1658000     -0.9188000    
 H    6.931500      0.4637000      0.7012000    
 H    9.795900     -0.5949000      0.2666000    
 H    9.033600     -0.2553000       1.821600    
 H    4.160800       3.474700     -0.8349000    
 H    6.027600       1.902500     -0.8699000    
 H    9.341000      -2.640300       2.504900    
 H    10.88240      -1.874600       2.083300    
 H    10.10720      -2.986700      0.9420000    


%chk=000037932-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000037932

0 1
O -1.226263 0.302828 0.125953
O -0.262160 2.386951 -0.407564
O 5.672646 -0.687208 0.323297
N -5.688629 -1.980321 -0.648567
N 1.023873 0.445100 0.067171
C -5.059754 0.325587 0.195108
C -6.057477 -0.872993 0.280516
C -5.441031 1.399852 1.252958
C -7.526977 -0.375474 0.130525
C -6.903968 1.879971 1.122572
C -7.884558 0.688222 1.194255
C -3.595511 -0.156498 0.360305
C -2.575857 0.920867 -0.008217
C -6.235618 -3.294981 -0.269040
C -5.853229 -1.700013 -2.086871
C -0.143528 1.173321 -0.104020
C 2.364510 0.901099 -0.058215
C 3.390511 -0.044834 0.175816
C 2.692811 2.241819 -0.402016
C 4.746518 0.337589 0.069024
C 7.886258 -1.631937 0.552803
C 7.106713 -0.355531 0.230018
C 9.415633 -1.409217 0.493404
C 4.051734 2.597773 -0.501803
C 5.092721 1.669215 -0.272375
C 10.208560 -2.692749 0.820998
H -5.168791 0.794356 -0.809027
H -5.952495 -1.296467 1.304052
H -5.286721 0.967482 2.264760
H -4.757893 2.267387 1.173168
H -7.661614 0.065870 -0.878032
H -8.220845 -1.236097 0.203235
H -7.132380 2.616922 1.916880
H -7.034880 2.403817 0.152991
H -8.927130 1.034501 1.053966
H -7.831506 0.231993 2.204819
H -3.445305 -1.046339 -0.276709
H -3.427074 -0.475566 1.408499
H -2.615536 1.804247 0.653984
H -2.700706 1.266589 -1.052305
H -5.748072 -4.083980 -0.872152
H -6.016444 -3.496781 0.794996
H -7.340486 -3.395870 -0.418135
H -6.918020 -1.644246 -2.423405
H -5.362530 -0.747291 -2.351463
H -5.362674 -2.501504 -2.670172
H 0.881512 -0.536565 0.314510
H 3.162292 -1.083074 0.442199
H 1.898350 2.967632 -0.581127
H 7.595542 -1.985438 1.560669
H 7.592044 -2.423573 -0.162814
H 7.339882 0.004150 -0.794334
H 7.350029 0.451818 0.952633
H 9.698611 -1.047100 -0.516117
H 9.701060 -0.607679 1.205095
H 4.309772 3.629500 -0.766212
H 6.135733 1.984170 -0.359613
H 9.966458 -3.058297 1.836412
H 11.298586 -2.516152 0.775157
H 9.965701 -3.501449 0.106557


