%chk=000122334.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122334

0 1
 O    3.772700       1.117100     -7.5300001E-02
 N   -2.720700       1.012800     -0.2545000    
 C   -1.302300      0.7866000      2.0800000E-02
 C  -0.8579000     -0.6726000     -0.2538000    
 C  -0.4496000       1.776100     -0.7775000    
 C   0.6444000     -0.8276000     -6.8400003E-02
 C    1.016600       1.680500     -0.3582000    
 C    1.518400      0.2717000     -0.1654000    
 C   -1.249700      -1.195800      -1.646000    
 C   -3.545600      7.3399998E-02  0.4889000    
 C    1.176700      -2.105800      0.1761000    
 C    2.899500      6.9499999E-02 -9.8000001E-03
 C    2.550800      -2.292500      0.3219000    
 C    3.412400      -1.204900      0.2275000    
 C   -5.024700      0.3405000      0.2217000    
 C   -5.910600     -0.6159000       1.005200    
 C    4.069600       1.786800       1.146800    
 H   -1.130600       1.000300       1.086700    
 H   -1.319400      -1.322400      0.5014000    
 H  -0.7940000       2.806300     -0.6214000    
 H  -0.5402000       1.579800      -1.853200    
 H    1.132300       2.215600      0.5922000    
 H    1.623400       2.200600      -1.109000    
 H   -2.971600       1.969700     -7.7000000E-03
 H   -2.322800      -1.112200      -1.838500    
 H  -0.7241000     -0.6582000      -2.442900    
 H  -0.9901000      -2.255500      -1.752100    
 H   -3.361300     -0.9654000      0.2018000    
 H   -3.352200      0.1657000       1.564900    
 H   0.5181000      -2.968000      0.2510000    
 H    2.947000      -3.286200      0.5090000    
 H   -5.279500       1.369900      0.5020000    
 H   -5.239600      0.2333000     -0.8486000    
 H    4.482100      -1.355200      0.3453000    
 H   -5.711000      -1.655200      0.7253000    
 H   -5.744900     -0.5117000       2.082300    
 H   -6.965600     -0.4069000      0.8025000    
 H    3.161900       2.037500       1.703600    
 H    4.600700       2.712800      0.9096000    
 H    4.720300       1.160700       1.765300    


%chk=000122334-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122334

0 1
O 3.505265 1.573082 0.422570
N -2.874741 0.767868 -0.307582
C -1.451588 0.675901 0.091677
C -0.846058 -0.724008 -0.230949
C -0.631849 1.775208 -0.614169
C 0.653624 -0.750328 0.079992
C 0.811547 1.820979 -0.071489
C 1.424920 0.439760 0.119526
C -1.115429 -1.171987 -1.693624
C -3.825623 -0.047897 0.477930
C 1.284835 -2.004278 0.301339
C 2.822919 0.337852 0.384296
C 2.666454 -2.084741 0.550950
C 3.452362 -0.909349 0.592806
C -5.281180 0.246558 0.063795
C -6.305640 -0.589947 0.859637
C 4.945975 1.543496 0.673261
H -1.335076 0.827713 1.198559
H -1.332042 -1.468319 0.433208
H -1.112407 2.762794 -0.459750
H -0.634841 1.585197 -1.703403
H 0.831743 2.350253 0.903536
H 1.457743 2.421540 -0.737761
H -3.179026 1.751603 -0.343260
H -2.190823 -1.080632 -1.923740
H -0.558463 -0.548117 -2.415073
H -0.795049 -2.218935 -1.843400
H -3.612516 -1.120100 0.296174
H -3.716241 0.114448 1.581998
H 0.678892 -2.918040 0.278076
H 3.140718 -3.057989 0.720038
H -5.491109 1.326856 0.212442
H -5.385425 0.051136 -1.020649
H 4.525726 -0.978344 0.791958
H -6.137508 -1.672787 0.707547
H -6.231260 -0.387526 1.944744
H -7.339791 -0.362449 0.543574
H 5.173826 1.106712 1.665476
H 5.263562 2.596742 0.651103
H 5.482471 0.975273 -0.111863


