%chk=000226413.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226413

0 1
 O   -2.793700       2.158400     -3.7900001E-02
 O   -1.092300       3.545500     -2.6200000E-02
 O    3.925700      -1.484700     -1.4200000E-02
 N   -1.560600       2.382700     -1.3800000E-02
 N    2.996900      0.6816000     -4.0000002E-03
 C   -2.549000     -0.5111000      3.9799999E-02
 C  -0.9166000      -2.436400      3.2900002E-02
 C   -2.369400      -2.014700      0.3914000    
 C   -1.117600     -3.2800000E-02  4.5899998E-02
 C  -0.2106000      -1.102600      4.2100001E-02
 C   -3.405800      0.1858000       1.105700    
 C   -3.190700     -0.3133000      -1.339100    
 C  -0.3655000      -3.400100       1.092800    
 C  -0.8313000      -3.096000      -1.349100    
 C  -0.6624000       1.280600      2.9700000E-02
 C    1.159500     -0.8683000      2.1900000E-02
 C   0.7129000       1.517900      1.7200001E-02
 C    1.618500      0.4498000      1.3500000E-02
 C    1.235200       2.923600     -7.9999998E-04
 C    4.030200     -0.2623000     -1.4800000E-02
 C    5.386600      0.3966000     -3.3000000E-02
 H   -3.119400      -2.647900     -9.7900003E-02
 H   -2.513400      -2.159100       1.472000    
 H   -2.839000      0.7469000       1.857900    
 H   -4.248500      0.7656000      0.7099000    
 H   -3.937600     -0.5758000       1.695100    
 H   -3.233400      0.7155000      -1.699600    
 H   -2.650500     -0.8662000      -2.113800    
 H   -4.217600     -0.6983000      -1.338000    
 H   0.6612000      -3.708200      0.8644000    
 H  -0.3513000      -2.939700       2.087900    
 H  -0.9778000      -4.307100       1.151300    
 H   -1.159100      -2.430800      -2.152600    
 H   0.1998000      -3.386600      -1.583500    
 H   -1.447800      -4.000800      -1.389900    
 H    1.795400      -1.739600      6.3000000E-03
 H   0.9626000       3.434900     -0.9315000    
 H   0.9261000       3.470900      0.8979000    
 H    2.317200       3.039100      2.8899999E-02
 H    3.324200       1.636800     -1.5500000E-02
 H    5.493100      0.9996000     -0.9392000    
 H    6.169400     -0.3669000     -2.0500001E-02
 H    5.501300       1.035200      0.8475000    


%chk=000226413-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226413

0 1
O -2.414271 2.598486 -0.869544
O -1.446810 3.259051 1.081170
O 3.972603 -1.458338 -0.127034
N -1.554244 2.448226 0.080861
N 3.044772 0.702765 -0.020766
C -2.628866 -0.532180 0.028638
C -0.954254 -2.459620 0.058169
C -2.420603 -2.044033 0.418315
C -1.172081 -0.023918 0.009913
C -0.249990 -1.099343 0.019833
C -3.532763 0.167552 1.078527
C -3.287005 -0.410341 -1.380108
C -0.354003 -3.397250 1.137652
C -0.853353 -3.162003 -1.327882
C -0.632695 1.284053 0.024172
C 1.138269 -0.890612 -0.001310
C 0.761189 1.560043 0.016295
C 1.645110 0.434394 -0.006801
C 1.329184 2.970088 -0.007777
C 4.111423 -0.201057 -0.076556
C 5.493054 0.450484 -0.069244
H -3.168925 -2.689584 -0.076053
H -2.560149 -2.149795 1.511535
H -3.051253 0.189840 2.073144
H -3.790737 1.200718 0.788515
H -4.481871 -0.392329 1.173829
H -3.398415 0.646674 -1.670703
H -2.685992 -0.917938 -2.154735
H -4.288217 -0.880442 -1.360412
H 0.688743 -3.675623 0.897285
H -0.358981 -2.915781 2.132490
H -0.944159 -4.330495 1.203716
H -1.278581 -2.542113 -2.136119
H 0.201953 -3.372604 -1.582025
H -1.398578 -4.124220 -1.308078
H 1.844878 -1.722559 -0.001182
H 0.549819 3.739959 -0.085197
H 1.890646 3.194844 0.920765
H 2.010419 3.108662 -0.870735
H 3.305489 1.688824 0.019840
H 6.044368 0.126653 -0.968726
H 6.056506 0.084635 0.806400
H 5.473272 1.553929 -0.042975


