%chk=000178369.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178369

0 1
 O   -4.165100       2.777600     -0.1295000    
 O   -2.621400      -3.247200     -0.2831000    
 O    6.111000     -0.4797000     -0.1359000    
 O   0.4652000       2.320700     -0.1697000    
 O  -0.7045000      -2.531400      0.7712000    
 N  -0.2056000      8.1100002E-02  3.0300001E-02
 C   -1.618700      0.1763000      4.6900000E-02
 C   -2.394900     -0.9658000      0.1577000    
 C   -2.194900       1.433100     -4.8700001E-02
 C    2.131700      0.6998000     -9.0499997E-02
 C   -3.584700       1.550300     -3.3100002E-02
 C   -3.784600     -0.8487000      0.1734000    
 C   0.7373000       1.113200     -7.2899997E-02
 C   -4.379600      0.4094000      7.7900000E-02
 C    3.121900       1.569100      0.3669000    
 C    2.478800     -0.5657000     -0.5637000    
 C   -1.804400      -2.294700      0.2590000    
 C    4.806400     -9.2399999E-02 -0.1221000    
 C    4.459300       1.173000      0.3511000    
 C    3.816200     -0.9618000     -0.5793000    
 C   -5.591000       2.824800     -0.1107000    
 C   -2.150400      -4.598600     -0.2428000    
 C    7.072000      0.4577000      0.3477000    
 H   -1.652000       2.361500     -0.1380000    
 H   0.1472000     -0.8631000      0.1463000    
 H   -4.432300      -1.715900      0.2738000    
 H   -5.463900      0.4290000      9.9299997E-02
 H    2.871500       2.557200      0.7445000    
 H    1.749400      -1.262300     -0.9662000    
 H    5.177000       1.896800      0.7220000    
 H    4.082000      -1.945600     -0.9565000    
 H   -6.022400       2.302000     -0.9711000    
 H   -5.880800       3.877100     -0.1980000    
 H   -5.993100       2.460500      0.8407000    
 H   -2.012500      -4.918800      0.7942000    
 H   -1.215000      -4.688700     -0.8029000    
 H   -2.904600      -5.236100     -0.7114000    
 H    6.915200      0.6839000       1.408000    
 H    7.098600       1.361600     -0.2701000    
 H    8.055800     -1.5699999E-02  0.2641000    


%chk=000178369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178369

0 1
O -4.245409 2.838364 0.070804
O -2.734264 -3.363106 -0.215455
O 6.212173 -0.520367 0.119060
O 0.419918 2.348410 0.135496
O -0.566249 -2.544542 -0.141546
N -0.258219 0.100564 0.000573
C -1.659073 0.225490 -0.017550
C -2.453473 -0.985380 -0.093673
C -2.312024 1.478964 0.035495
C 2.134738 0.635066 0.083447
C -3.722390 1.545593 0.013992
C -3.868657 -0.873074 -0.112722
C 0.707964 1.109976 0.076302
C -4.518020 0.367962 -0.060492
C 3.139465 1.632491 0.149128
C 2.537877 -0.731401 0.031242
C -1.820769 -2.312687 -0.149569
C 4.889958 -0.063508 0.110933
C 4.507594 1.301808 0.163350
C 3.898522 -1.076417 0.044855
C -5.703850 2.995423 0.052177
C -2.146914 -4.721077 -0.274241
C 7.280239 0.482528 0.185278
H -1.721321 2.394158 0.093109
H 0.052843 -0.885936 -0.048042
H -4.454370 -1.794121 -0.170237
H -5.609803 0.412771 -0.077549
H 2.814125 2.677299 0.189401
H 1.809454 -1.548640 -0.019559
H 5.255190 2.098752 0.214802
H 4.219896 -2.121394 0.005470
H -6.138349 2.596020 -0.884180
H -5.872538 4.080430 0.106890
H -6.172208 2.499689 0.923903
H -1.528437 -4.910692 0.618906
H -1.521583 -4.829625 -1.176203
H -3.013260 -5.396360 -0.308531
H 7.214357 1.077711 1.116347
H 7.251321 1.157787 -0.691422
H 8.215647 -0.095432 0.178813


