%chk=000137332.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137332

0 1
 O   -3.153300       2.531200      0.3387000    
 O   -4.215500      -2.069000     -0.1609000    
 N    2.891300      7.7699997E-02 -0.1911000    
 C    1.487900      0.4142000      0.1563000    
 C   0.5356000     -0.7243000     -0.3290000    
 C   0.9527000      -2.048300      0.3400000    
 C    1.004200       1.737300     -0.4617000    
 C  -0.9415000     -0.3837000     -0.1491000    
 C    2.426700      -2.338600      8.8100001E-02
 C    3.306300      -1.161900      0.4881000    
 C  -0.3821000       2.091800      6.8499997E-02
 C   -1.361400      0.9517000      6.0999999E-03
 C    3.838000       1.142900      0.1518000    
 C   -1.929100      -1.383200     -0.2254000    
 C   -2.728800       1.247400      0.1491000    
 C    5.239800      0.7540000     -0.2772000    
 C   -3.285400      -1.077200     -9.3500003E-02
 C   -3.685400      0.2380000      0.1012000    
 H    1.408200      0.5074000       1.250400    
 H   0.6751000     -0.8410000      -1.415100    
 H   0.3777000      -2.896100     -4.5499999E-02
 H   0.7623000      -1.999400       1.419900    
 H   0.9841000       1.657000      -1.556500    
 H    1.655900       2.579600     -0.2120000    
 H    2.725800      -3.232200      0.6482000    
 H    2.576200      -2.565700     -0.9754000    
 H    3.285900      -1.036800       1.578900    
 H    4.320800      -1.464000      0.2123000    
 H  -0.7419000       2.939900     -0.5267000    
 H  -0.2956000       2.419100       1.112400    
 H    3.603700       2.054600     -0.4048000    
 H    3.818200       1.387200       1.220700    
 H   -1.649800      -2.418200     -0.4015000    
 H    5.717700      5.7900000E-02  0.4191000    
 H    5.260900      0.3283000      -1.286600    
 H    5.874600       1.647800     -0.2937000    
 H   -4.740000      0.4779000      0.2084000    
 H   -2.425200       3.093000      0.6464000    
 H   -3.763200      -2.918900     -0.2986000    


%chk=000137332-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137332

0 1
O -3.239299 2.540105 0.402730
O -4.302510 -2.079007 -0.197587
N 2.909925 0.048074 -0.169212
C 1.492810 0.398347 0.178770
C 0.542111 -0.735378 -0.313522
C 0.928984 -2.076409 0.361804
C 1.026855 1.734999 -0.433032
C -0.945346 -0.378531 -0.149380
C 2.412084 -2.391675 0.092029
C 3.309220 -1.215668 0.509107
C -0.366502 2.115351 0.109756
C -1.362225 0.966377 0.043864
C 3.881740 1.142783 0.118918
C -1.925446 -1.400796 -0.233705
C -2.755120 1.235673 0.179140
C 5.323764 0.824223 -0.324234
C -3.299450 -1.093349 -0.114229
C -3.731367 0.227876 0.100937
H 1.386655 0.478267 1.297581
H 0.750494 -0.844574 -1.400829
H 0.304441 -2.906659 -0.014083
H 0.743934 -2.000972 1.452798
H 1.001419 1.635725 -1.535448
H 1.719327 2.558146 -0.188860
H 2.721664 -3.300849 0.642840
H 2.559690 -2.586831 -0.987927
H 3.266689 -1.097060 1.625914
H 4.354063 -1.444965 0.242228
H -0.730230 2.984415 -0.481766
H -0.258067 2.468912 1.158391
H 3.561656 2.039540 -0.436787
H 3.878931 1.413470 1.208465
H -1.622989 -2.441588 -0.398473
H 5.817436 0.073804 0.317358
H 5.328777 0.452723 -1.364815
H 5.935317 1.744224 -0.281801
H -4.791929 0.466561 0.202176
H -2.496243 3.192570 0.426064
H -3.899861 -2.970455 -0.344881


