%chk=000039053.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039053

0 1
 O   -2.182700      -1.649900       1.514800    
 N  -0.4118000      -2.039100      5.7999998E-02
 C   0.6229000     -0.1024000      -1.128500    
 C   0.3163000      -1.617400      -1.146700    
 C  -0.6024000      0.6863000     -0.7208000    
 C   -1.591100      0.1144000      9.3900003E-02
 C    1.862200      0.2248000     -0.3020000    
 C  -0.4692000      -2.015600      -2.405300    
 C   -1.436200      -1.269300      0.6154000    
 C   -2.716700      0.8624000      0.4627000    
 C  -0.7556000       2.013200      -1.151900    
 C  -0.1399000      -3.376600      0.5675000    
 C    1.732000      0.4997000       1.054700    
 C    3.111300      0.2447000     -0.9124000    
 C   -2.859000       2.177200      1.9300001E-02
 C   -1.879200       2.752900     -0.7850000    
 C   -3.832600      0.3321000       1.306300    
 C    2.865300      0.7987000       1.810800    
 C    4.244700      0.5436000     -0.1562000    
 C    4.121600      0.8206000       1.205400    
 H   0.8542000      0.1945000      -2.162800    
 H    1.264900      -2.170700      -1.170500    
 H  -0.6363000      -3.097700      -2.432100    
 H   -1.451900      -1.534200      -2.445900    
 H   8.2800001E-02  -1.742200      -3.310600    
 H   1.1000000E-03   2.477200      -1.779900    
 H  -0.4223000      -4.110800     -0.1918000    
 H  -0.7034000      -3.577500       1.482200    
 H   0.9288000      -3.461900      0.7842000    
 H   0.7761000      0.4807000       1.566500    
 H    3.220100      2.8000001E-02  -1.971400    
 H   -3.726200       2.773800      0.2905000    
 H   -1.989300       3.777800      -1.127000    
 H   -3.504100      0.1755000       2.338700    
 H   -4.672200       1.036100       1.356000    
 H   -4.246800     -0.5887000      0.8826000    
 H    2.770400       1.011400       2.871700    
 H    5.223200      0.5597000     -0.6272000    
 H    5.004200       1.052300       1.794300    


%chk=000039053-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039053

0 1
O -1.887908 -1.643766 1.735230
N -0.337838 -1.978844 0.033510
C 0.619733 -0.031762 -1.178503
C 0.293083 -1.554180 -1.240229
C -0.633756 0.740593 -0.782417
C -1.587966 0.147416 0.097764
C 1.838188 0.244496 -0.282512
C -0.584477 -1.923569 -2.461110
C -1.304077 -1.214258 0.683008
C -2.776820 0.863960 0.455942
C -0.842127 2.042648 -1.284840
C 0.015887 -3.304664 0.561527
C 1.719254 0.541301 1.098462
C 3.137739 0.156396 -0.847317
C -2.958094 2.165512 -0.078027
C -2.003266 2.759210 -0.930830
C -3.853781 0.304182 1.367637
C 2.870987 0.736918 1.894068
C 4.290634 0.353875 -0.055836
C 4.160369 0.643226 1.322496
H 0.897582 0.266703 -2.208477
H 1.250170 -2.105195 -1.313063
H -0.840244 -2.998059 -2.443528
H -1.524781 -1.345262 -2.462714
H -0.046025 -1.715418 -3.404245
H -0.095230 2.489869 -1.951110
H -0.180987 -4.094286 -0.189338
H -0.599937 -3.493042 1.454265
H 1.086239 -3.337557 0.840264
H 0.727451 0.633779 1.552979
H 3.246878 -0.061083 -1.918242
H -3.867329 2.718349 0.185446
H -2.170053 3.769036 -1.321978
H -3.478789 0.185179 2.398185
H -4.732235 0.973683 1.374465
H -4.172040 -0.705909 1.058037
H 2.759979 0.965323 2.960116
H 5.285126 0.288633 -0.511914
H 5.051660 0.800167 1.940330


