%chk=000156116.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156116

0 1
 O    1.399200      -1.402400       1.122000    
 O   -2.261100       1.442700      0.9396000    
 N   -3.059300     -0.3440000     -0.3187000    
 N   -4.390700       1.566800      4.0500000E-02
 C    3.769500     -0.9751000      0.9486000    
 C    2.629300      -1.938400      0.6374000    
 C    3.590200      0.3633000      0.2740000    
 C   0.2660000      -1.748500      0.4515000    
 C   -1.959900      -1.237200     -0.2767000    
 C  -0.8157000     -0.8688000      0.4095000    
 C    4.115000      0.5612000     -0.9934000    
 C    2.904500       1.370600      0.9343000    
 C   0.1866000      -2.982700     -0.1935000    
 C   -2.056100      -2.457700     -0.9225000    
 C  -0.9745000      -3.337400     -0.8805000    
 C    3.949700       1.798200      -1.616700    
 C    2.739200       2.607600      0.3111000    
 C   -3.152500      0.9215000      0.2659000    
 C    3.261800       2.821200     -0.9643000    
 C   -4.689300       2.883800      0.5886000    
 C   -5.451900      0.9552000     -0.7568000    
 H    3.834700     -0.8189000       2.033300    
 H    4.725600      -1.419200      0.6453000    
 H    2.818000      -2.896300       1.135600    
 H    2.604100      -2.096300     -0.4491000    
 H  -0.6711000      6.4599998E-02  0.9311000    
 H    4.650300     -0.2302000      -1.510000    
 H    2.493300       1.215400       1.927600    
 H   0.9939000      -3.708300     -0.1612000    
 H   -2.956100      -2.744300      -1.458900    
 H   -3.852200     -0.6976000     -0.8428000    
 H   -1.039200      -4.301100      -1.377200    
 H    4.356100       1.964400      -2.610100    
 H    2.203100       3.404100      0.8188000    
 H    3.132800       3.784200      -1.449700    
 H   -5.568500       2.805800       1.234500    
 H   -4.894700       3.571100     -0.2371000    
 H   -3.850100       3.269000       1.173000    
 H   -6.310000       1.629800     -0.8328000    
 H   -5.774000      2.5800001E-02 -0.2777000    
 H   -5.077800      0.7476000      -1.763800    


%chk=000156116-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156116

0 1
O 1.263377 -0.918099 0.595086
O -2.789768 1.502361 1.000089
N -3.515093 -0.409207 -0.177227
N -5.035607 1.314768 0.358908
C 3.641640 -0.822270 1.072289
C 2.524147 -1.661614 0.428512
C 4.036993 0.416364 0.277894
C 0.094359 -1.470656 0.045030
C -2.299070 -1.136777 -0.294494
C -1.065060 -0.678085 0.218691
C 5.302756 0.486921 -0.358894
C 3.151479 1.519561 0.151613
C 0.047514 -2.716019 -0.629330
C -2.363663 -2.389379 -0.974576
C -1.197950 -3.158469 -1.132362
C 5.678307 1.626678 -1.107478
C 3.523758 2.658587 -0.596042
C -3.715704 0.843355 0.430909
C 4.788151 2.717874 -1.228449
C -5.345824 2.611501 0.981190
C -6.122701 0.586299 -0.309667
H 3.302074 -0.544143 2.088412
H 4.523110 -1.480735 1.193785
H 2.437866 -2.643886 0.938573
H 2.723937 -1.828539 -0.649436
H -1.005606 0.276552 0.742762
H 6.001730 -0.354345 -0.264860
H 2.168254 1.471904 0.630681
H 0.940580 -3.331096 -0.766008
H -3.319523 -2.750425 -1.374885
H -4.324168 -0.870350 -0.593777
H -1.253940 -4.119109 -1.656449
H 6.661712 1.663324 -1.590448
H 2.827066 3.500048 -0.684695
H 5.076111 3.603654 -1.806148
H -6.109459 2.498841 1.774888
H -5.715526 3.334797 0.228788
H -4.419700 3.003349 1.428193
H -7.042336 1.189823 -0.253778
H -6.342880 -0.386968 0.176926
H -5.913145 0.413112 -1.385517


