%chk=000121903.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121903

0 1
 O   7.0100002E-02  -2.179000     -0.2254000    
 N   -3.843600     -0.4983000      0.2473000    
 N    2.223000       1.837300      7.3200002E-02
 C   -1.452500       1.140900     -0.1688000    
 C   -1.373500     -0.3119000      0.3700000    
 C   -2.810900       1.751700      0.1820000    
 C  -0.2885000       2.006800      0.3611000    
 C   -2.571700      -1.131000     -0.1319000    
 C   -3.954700      0.8589000     -0.3035000    
 C   0.9822000       1.267700      0.1409000    
 C  -3.4899998E-02 -0.9748000     -1.3100000E-02
 C    1.119600     -9.3599997E-02 -3.6300000E-02
 C    2.496800     -0.3545000     -0.2313000    
 C    3.155200      0.8558000     -0.1561000    
 C   -4.973200      -1.320100     -0.1874000    
 C    3.125300      -1.670400     -0.4679000    
 C    4.588500       1.186100     -0.2811000    
 C    3.542800      -2.371800      0.8285000    
 H   -1.367400       1.101900      -1.265800    
 H   -1.398100     -0.2899000       1.469500    
 H   -2.904400       2.743900     -0.2754000    
 H   -2.891800       1.891900       1.267800    
 H  -0.4119000       2.203400       1.432800    
 H  -0.2726000       2.972000     -0.1578000    
 H   -2.507400      -1.263000      -1.220900    
 H   -2.520500      -2.133700      0.3116000    
 H   -4.900000       1.313000      1.7999999E-02
 H   -3.962100      0.8353000      -1.401300    
 H    2.420900       2.824200      0.1694000    
 H   -4.921400      -2.316400      0.2657000    
 H   -5.004800      -1.437400      -1.276700    
 H   -5.920300     -0.8767000      0.1396000    
 H    2.453800      -2.325900      -1.033000    
 H    4.014700      -1.549900      -1.099200    
 H    5.188100      0.5639000      0.3912000    
 H    4.931900       1.012200      -1.306000    
 H    4.789700       2.233200     -3.2000002E-02
 H    4.262400      -1.767400       1.390800    
 H    4.008700      -3.336000      0.6027000    
 H    2.676700      -2.552700       1.473900    


%chk=000121903-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121903

0 1
O 0.084968 -2.216168 -0.138516
N -3.821645 -0.517458 0.238249
N 2.257685 1.905172 0.007556
C -1.454268 1.176639 -0.206733
C -1.348335 -0.275839 0.339461
C -2.839759 1.763836 0.144275
C -0.296230 2.062114 0.325719
C -2.530964 -1.130985 -0.156270
C -3.975995 0.839510 -0.334900
C 1.001443 1.339379 0.110684
C 0.007568 -0.953807 0.021762
C 1.159810 -0.056102 -0.036245
C 2.577317 -0.332156 -0.243088
C 3.236717 0.901894 -0.207504
C -4.968130 -1.391165 -0.076674
C 3.209214 -1.692442 -0.425385
C 4.687961 1.262638 -0.351060
C 3.325264 -2.489451 0.901568
H -1.362788 1.125469 -1.313432
H -1.425548 -0.219320 1.449023
H -2.958467 2.765511 -0.315635
H -2.920918 1.885287 1.242720
H -0.463513 2.258742 1.407079
H -0.304960 3.047685 -0.182264
H -2.452860 -1.251358 -1.269359
H -2.457056 -2.141376 0.280003
H -4.954347 1.245528 -0.015423
H -3.978845 0.810079 -1.458698
H 2.458600 2.903303 0.062591
H -4.841348 -2.365609 0.427479
H -5.090181 -1.584351 -1.173305
H -5.901727 -0.930984 0.294962
H 2.594870 -2.284788 -1.127538
H 4.214384 -1.583237 -0.877889
H 5.281510 0.357658 -0.559477
H 4.863945 1.972190 -1.183488
H 5.099971 1.719850 0.570272
H 3.919889 -1.934770 1.650814
H 3.810479 -3.467731 0.726983
H 2.320488 -2.677688 1.316782


