%chk=000078347.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078347

0 1
 O    3.795500      1.5000000E-03  9.9999997E-05
 O    2.066900       3.707000     -0.3170000    
 O    2.069600      -3.705100      0.3183000    
 O    1.789100       2.251900      -1.937100    
 O    1.790500      -2.249200       1.937500    
 O   -4.323500       2.234700      0.6128000    
 O   -4.321800      -2.237900     -0.6130000    
 O   -3.457800       3.659800     -0.8152000    
 O   -3.455300      -3.661400      0.8158000    
 N    1.797500      0.5885000       1.043800    
 N    1.798300     -0.5877000      -1.044300    
 N    1.453300       2.744900     -0.8350000    
 N    1.455300      -2.743200      0.8357000    
 N   -3.337400       2.720400      7.7999998E-03
 N   -3.335300      -2.722400     -7.6000001E-03
 C    2.559600      1.0000000E-03 -3.0000001E-04
 C   0.4940000       1.148400      0.7640000    
 C   0.4950000      -1.148300     -0.7644000    
 C    2.338100      0.6256000       2.408800    
 C    2.338700     -0.6253000      -2.409500    
 C   0.3362000       2.192500     -0.1472000    
 C   0.3379000      -2.192100      0.1474000    
 C  -0.6176000      0.6251000       1.424600    
 C  -0.6168000     -0.6261000      -1.425400    
 C    3.136600       1.888900       2.655300    
 C    3.138000      -1.888300      -2.655100    
 C  -0.9332000       2.713600     -0.3980000    
 C  -0.9311000      -2.713700      0.3983000    
 C   -1.886900       1.146200       1.173700    
 C   -1.885900      -1.148000      -1.174400    
 C   -2.044600       2.190400      0.2626000    
 C   -2.043000      -2.191800     -0.2627000    
 H    3.018000     -0.2220000       2.541300    
 H    1.530600      0.5302000       3.141000    
 H    3.017700      0.2229000      -2.542500    
 H    1.531100     -0.5310000      -3.141600    
 H  -0.5160000     -0.1759000       2.151800    
 H  -0.5157000      0.1747000      -2.152900    
 H    3.558900       1.881900       3.664900    
 H    2.504500       2.777600       2.558400    
 H    3.960900       1.988100       1.941800    
 H    3.560300      -1.881700      -3.664800    
 H    2.506500      -2.777400      -2.557600    
 H    3.962500      -1.986400      -1.941600    
 H   -1.034300       3.527400      -1.113200    
 H   -1.031800      -3.527200       1.114000    
 H   -2.729500      0.7163000       1.709600    
 H   -2.728600     -0.7190000      -1.710600    


%chk=000078347-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000078347

0 1
O 3.824301 -0.000540 0.000275
O 2.314206 2.601589 -0.940459
O 2.312732 -2.601822 0.941364
O 0.648215 2.251487 -2.461649
O 0.646391 -2.250617 2.461998
O -4.170294 2.796855 1.675137
O -4.170606 -2.796400 -1.676711
O -3.655122 3.579488 -0.409696
O -3.656529 -3.578498 0.408600
N 1.813106 0.500867 1.097726
N 1.812938 -0.501273 -1.097188
N 1.109271 2.266489 -1.254050
N 1.107848 -2.266122 1.254532
N -3.367788 2.940277 0.674560
N -3.368478 -2.939923 -0.675837
C 2.569599 -0.000493 0.000323
C 0.556289 1.146247 0.973400
C 0.555823 -1.146235 -0.973181
C 2.562991 0.606086 2.396530
C 2.562775 -0.606544 -2.396011
C 0.166119 1.932152 -0.159441
C 0.165156 -1.931977 0.159546
C -0.406481 1.006321 2.015964
C -0.406431 -1.006395 -2.016225
C 3.152130 2.011065 2.611972
C 3.151713 -2.011583 -2.611598
C -1.115972 2.494824 -0.278758
C -1.117033 -2.494547 0.278418
C -1.675889 1.595729 1.936821
C -1.675919 -1.595700 -1.937538
C -2.023885 2.328560 0.779674
C -2.024459 -2.328346 -0.780439
H 3.365892 -0.146186 2.351536
H 1.885312 0.320085 3.218303
H 3.365771 0.145630 -2.351042
H 1.885091 -0.320449 -3.217757
H -0.163140 0.382559 2.879336
H -0.162536 -0.382977 -2.879683
H 3.701962 2.037110 3.569899
H 2.362839 2.782963 2.649529
H 3.852020 2.262217 1.798922
H 3.701499 -2.037568 -3.569551
H 2.362326 -2.783379 -2.649196
H 3.851613 -2.262924 -1.798614
H -1.394036 3.073572 -1.163653
H -1.395538 -3.073125 1.163280
H -2.410558 1.474572 2.737076
H -2.410238 -1.474722 -2.738143


