%chk=000133559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133559

0 1
 O    2.780900       1.651800     -0.7390000    
 O    3.992400     -0.3541000      0.7562000    
 N   -4.377900     -0.7260000      -1.229300    
 C   -2.343000     -0.2867000      0.1942000    
 C   -3.801800     -0.7673000      0.1138000    
 C   -2.445100       1.240700      0.1235000    
 C   -4.500200      0.2535000       1.015700    
 C   -3.807900       1.587300      0.7300000    
 C   -1.395000     -0.8736000     -0.8409000    
 C   3.9600000E-02 -0.7317000     -0.4167000    
 C   0.7527000      0.4045000     -0.7776000    
 C   0.6368000      -1.739100      0.3307000    
 C    2.084600      0.5357000     -0.3846000    
 C    1.968700      -1.608000      0.7237000    
 C    2.692600     -0.4706000      0.3660000    
 C    2.738700       2.755700      0.1630000    
 C    4.983800     -0.8720000     -0.1288000    
 H   -1.981200     -0.5503000       1.200200    
 H   -3.905300      -1.782500      0.5107000    
 H   -2.401300       1.604100     -0.9100000    
 H   -1.633500       1.725500      0.6762000    
 H   -4.340800     -1.9500000E-02   2.066800    
 H   -5.582900      0.3099000      0.8603000    
 H   -3.703700       2.178100       1.646000    
 H   -4.392900       2.183200      2.0400001E-02
 H   -1.542100     -0.4163000      -1.827700    
 H   -1.612900      -1.941100     -0.9796000    
 H   -4.303800      0.2119000      -1.620200    
 H   -5.374600     -0.9336000      -1.180300    
 H   0.2844000       1.190000      -1.365100    
 H   8.1799999E-02  -2.628200      0.6169000    
 H    2.435500      -2.395200       1.309500    
 H    3.343000       3.564400     -0.2567000    
 H    3.156200       2.475100       1.135200    
 H    1.711000       3.112700      0.2840000    
 H    4.943000     -0.3601000      -1.095400    
 H    4.848400      -1.949300     -0.2678000    
 H    5.966400     -0.6977000      0.3179000    


%chk=000133559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133559

0 1
O 2.805768 1.515349 -1.078749
O 4.006357 -0.286080 0.896764
N -4.324693 -0.457088 -1.480976
C -2.509562 -0.428194 0.255413
C -4.004592 -0.735109 -0.060748
C -2.480279 1.117972 0.451320
C -4.735097 0.183626 0.966774
C -3.908459 1.509763 0.967987
C -1.499690 -0.985294 -0.779187
C -0.049559 -0.790861 -0.358644
C 0.738650 0.256966 -0.894998
C 0.541484 -1.642186 0.612917
C 2.074373 0.455351 -0.485137
C 1.883659 -1.468400 1.011943
C 2.665652 -0.432114 0.458171
C 3.256298 2.556224 -0.126809
C 5.019660 -0.483882 -0.165427
H -2.294760 -0.900383 1.236997
H -4.231503 -1.803272 0.117436
H -2.258574 1.617098 -0.512756
H -1.682892 1.422546 1.150645
H -4.702319 -0.284755 1.970363
H -5.798073 0.337667 0.705577
H -3.873454 1.958399 1.976452
H -4.370572 2.262736 0.302682
H -1.695569 -0.508038 -1.756150
H -1.709403 -2.064536 -0.917318
H -4.167336 0.520204 -1.754276
H -5.262792 -0.768584 -1.754631
H 0.324103 0.945227 -1.640162
H -0.049380 -2.459714 1.043912
H 2.354625 -2.134498 1.742483
H 3.842558 3.269323 -0.726612
H 3.878764 2.118234 0.674373
H 2.381478 3.068741 0.317427
H 4.860885 0.222862 -1.000062
H 4.976892 -1.523342 -0.543235
H 5.991952 -0.300758 0.317445


