%chk=000089372.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089372

0 1
 O   -2.403200     -0.1530000      -1.287000    
 O  -4.2399999E-02   2.377700      0.3321000    
 O  -6.4199999E-02  -2.267900      0.6811000    
 N   0.3670000      4.8999999E-02  0.4621000    
 C   -1.831400      0.8419000      0.7203000    
 C   -1.831200     -0.6695000      0.8911000    
 C   -2.712000       1.033800     -0.5160000    
 C   -2.729400      -1.124400     -0.2621000    
 C   -4.175100      0.7654000     -0.1639000    
 C   -4.185400     -0.7558000      2.3100000E-02
 C  -0.3935000       1.212500      0.4676000    
 C  -0.3975000      -1.089500      0.6903000    
 C    1.782700      2.3100000E-02  0.2348000    
 C    2.302300     -0.1079000      -1.055400    
 C    2.651900      0.1320000       1.323000    
 C    3.682400     -0.1299000      -1.256100    
 C    1.399500     -0.2269000      -2.240300    
 C    4.032200      0.1102000       1.122400    
 C    4.547300     -2.0800000E-02 -0.1671000    
 H   -2.195700       1.378400       1.601800    
 H   -2.177700      -1.001800       1.874200    
 H   -2.533800       1.947600      -1.087400    
 H   -2.572100      -2.148200     -0.6093000    
 H   -4.828800       1.033800      -1.001500    
 H   -4.509800       1.309100      0.7243000    
 H   -4.517800      -1.063300       1.018900    
 H   -4.851100      -1.209600     -0.7196000    
 H    2.262300      0.2347000       2.332800    
 H    4.101100     -0.2313000      -2.253800    
 H   0.7701000      -1.118700      -2.156100    
 H   0.7623000      0.6591000      -2.328900    
 H    1.963900     -0.3149000      -3.175100    
 H    4.705700      0.1952000       1.970200    
 H    5.622000     -3.7900001E-02 -0.3231000    


%chk=000089372-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089372

0 1
O -2.356093 0.243794 -1.342145
O 0.073333 2.339306 0.864791
O 0.030759 -2.329017 0.279757
N 0.380045 0.011744 0.486448
C -1.851616 0.764900 0.919901
C -1.864807 -0.784106 0.736596
C -2.720803 1.244457 -0.290323
C -2.751969 -0.955948 -0.539721
C -4.210973 0.911191 -0.007102
C -4.232331 -0.652781 -0.179847
C -0.386993 1.179838 0.771864
C -0.407680 -1.173082 0.478476
C 1.803436 0.039088 0.230638
C 2.304801 -0.357708 -1.040306
C 2.660441 0.490811 1.258933
C 3.709933 -0.304839 -1.225765
C 1.392643 -0.813102 -2.161673
C 4.052761 0.540617 1.044703
C 4.578453 0.133494 -0.202595
H -2.247099 1.130575 1.881008
H -2.254449 -1.358961 1.591857
H -2.494218 2.254040 -0.656305
H -2.557192 -1.864324 -1.124286
H -4.857910 1.402472 -0.751753
H -4.530101 1.238639 0.997506
H -4.558341 -1.183184 0.731561
H -4.893474 -0.952443 -1.008949
H 2.231719 0.805055 2.215715
H 4.122616 -0.606562 -2.195624
H 1.068382 -1.857451 -1.996384
H 0.477391 -0.196779 -2.226892
H 1.913439 -0.764375 -3.132738
H 4.717469 0.891516 1.840871
H 5.659028 0.165329 -0.380818


