%chk=000130087.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130087

0 1
 O   0.3267000      -2.471500     -0.4631000    
 N   -1.608000     -0.7863000     -0.1308000    
 N   -4.426900      -1.133600     -8.3999997E-03
 N   3.9999999E-04   1.006400     -1.4500000E-02
 N   0.6988000      -1.264300     -0.2442000    
 N  -0.9271000       1.858300      0.4906000    
 N   0.9142000       3.010300     -0.1978000    
 C   -2.377800     -0.8827000      -1.365100    
 C   -2.208000      -1.412300       1.041200    
 C   -3.812200     -0.4090000      -1.130600    
 C   -3.646400     -0.9269000       1.220500    
 C  -0.2074000     -0.3743000     -0.1390000    
 C    1.069300       1.737800     -0.4913000    
 C   -5.811300     -0.7035000      0.1841000    
 C    2.149500       1.132400      -1.298900    
 C    2.132000      -1.051900     -2.3499999E-02
 C    2.835300      4.6500001E-02 -0.5325000    
 C  -0.3075000       3.032700      0.3952000    
 C    2.812200      -2.035100      0.7156000    
 C    4.218800      0.1348000     -0.3018000    
 C    4.184000      -1.929600      0.9408000    
 C    4.888400     -0.8460000      0.4290000    
 C  -0.8971000       4.267700      0.9246000    
 H   -2.369200      -1.920800      -1.718300    
 H   -1.917000     -0.2682000      -2.147000    
 H   -1.628800      -1.166300       1.938600    
 H   -2.184800      -2.502500      0.9251000    
 H   -4.387000     -0.5813000      -2.048500    
 H   -3.815300      0.6727000     -0.9393000    
 H   -3.643500      0.1350000       1.501500    
 H   -4.097800      -1.484100       2.050100    
 H    2.860900       1.914500      -1.590500    
 H    1.745600      0.7218000      -2.232600    
 H   -6.281300      -1.272600      0.9939000    
 H   -6.402200     -0.8954000     -0.7184000    
 H   -5.884900      0.3634000      0.4243000    
 H    2.284000      -2.891200       1.128200    
 H    4.787200      0.9780000     -0.6879000    
 H    4.701100      -2.693700       1.513500    
 H    5.957300     -0.7610000      0.6008000    
 H  -0.2746000       5.135400      0.6846000    
 H   -1.890300       4.438400      0.4973000    
 H  -0.9946000       4.213000       2.013300    


%chk=000130087-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130087

0 1
O 0.504986 -2.706643 -0.491947
N -1.590560 -0.892612 -0.622953
N -4.380616 -0.963316 0.063639
N -0.023204 0.912610 -0.389924
N 0.730699 -1.373186 -0.310961
N -0.939683 1.830585 0.191443
N 0.912159 2.932508 -0.682059
C -2.579364 -0.149549 -1.437010
C -2.164441 -2.084218 0.051750
C -3.802116 0.241049 -0.582794
C -3.370705 -1.648535 0.906741
C -0.298778 -0.477983 -0.430493
C 1.068295 1.611770 -0.908306
C -5.622569 -0.661364 0.800423
C 2.248080 0.887901 -1.475720
C 2.066903 -1.038039 0.183219
C 2.841793 0.010122 -0.379813
C -0.320707 3.025068 -0.023220
C 2.609947 -1.898483 1.164367
C 4.154432 0.214069 0.107009
C 3.918470 -1.680177 1.636816
C 4.694135 -0.619045 1.109962
C -0.918260 4.324163 0.416654
H -2.907063 -0.813726 -2.262326
H -2.116389 0.751606 -1.867790
H -1.388630 -2.578275 0.653027
H -2.500734 -2.801957 -0.719518
H -4.570970 0.692788 -1.237657
H -3.477606 1.005010 0.163430
H -3.013591 -0.996084 1.744568
H -3.834488 -2.550020 1.350168
H 2.976417 1.631899 -1.831183
H 1.937441 0.263433 -2.337540
H -6.049562 -1.595855 1.206826
H -6.364592 -0.218351 0.111945
H -5.472985 0.050187 1.651675
H 1.998809 -2.731829 1.520185
H 4.756912 1.026406 -0.315412
H 4.334944 -2.336804 2.407930
H 5.714884 -0.450967 1.469443
H -1.060554 4.998275 -0.446494
H -1.890540 4.153989 0.905016
H -0.245900 4.838580 1.125686


