%chk=000018380.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018380

0 1
 O   -4.890700      0.1742000     -0.8201000    
 O   -8.054600      -1.232900      0.1179000    
 O   -7.548300      0.7745000     -0.8317000    
 C    3.958500     -0.1075000     -0.1120000    
 C    5.366200      1.2800000E-02  0.4760000    
 C    2.848900      0.1655000      0.9084000    
 C    6.435800     -0.2461000     -0.5888000    
 C    1.442400      0.1178000      0.3015000    
 C    7.843400     -8.7700002E-02 -9.3000000E-03
 C   0.3384000      0.3816000       1.332800    
 C    8.952400     -0.3659000      -1.026200    
 C   -1.055300      0.3269000      0.7592000    
 C    10.35210     -0.1407000     -0.4751000    
 C   -1.646100       1.482900      0.2491000    
 C   -1.753400     -0.8805000      0.7386000    
 C   -2.935000       1.431700     -0.2815000    
 C   -3.042400     -0.9318000      0.2081000    
 C   -3.633200      0.2242000     -0.3019000    
 C   -5.781200     -0.7961000     -0.2711000    
 C   -7.197800     -0.3028000     -0.3741000    
 H    3.856400      0.5978000     -0.9462000    
 H    3.822500      -1.113000     -0.5291000    
 H    5.482200     -0.7022000       1.299400    
 H    5.501000       1.016500      0.8969000    
 H    3.009500       1.152600       1.359200    
 H    2.919000     -0.5691000       1.720000    
 H    6.316400      -1.258900     -0.9919000    
 H    6.304600      0.4527000      -1.423700    
 H    1.283200     -0.8646000     -0.1610000    
 H    1.371900      0.8568000     -0.5066000    
 H    7.959600      0.9323000      0.3778000    
 H    7.964400     -0.7657000      0.8447000    
 H   0.4971000       1.363100       1.798500    
 H   0.4182000     -0.3457000       2.151500    
 H    8.870500      -1.401000      -1.378400    
 H    8.812100      0.2793000      -1.901600    
 H    10.48180      0.8970000     -0.1517000    
 H    11.10230     -0.3554000      -1.242300    
 H    10.54320     -0.7942000      0.3820000    
 H   -1.111300       2.428900      0.2578000    
 H   -1.300200      -1.789200       1.126100    
 H   -3.390000       2.335300     -0.6778000    
 H   -3.541000      -1.896300      0.1860000    
 H   -5.588700     -0.9616000      0.7963000    
 H   -5.691300      -1.725900     -0.8423000    
 H   -8.988000     -0.9363000      6.2300000E-02


%chk=000018380-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018380

0 1
O -5.002366 0.375669 -0.483718
O -8.008574 -1.634577 -0.778686
O -7.544288 0.496172 -1.603524
C 3.938443 0.010776 -0.076255
C 5.392642 0.052659 0.445397
C 2.885035 0.256228 1.027424
C 6.446404 -0.183915 -0.660036
C 1.432415 0.200652 0.505333
C 7.900909 -0.150083 -0.138838
C 0.379822 0.462881 1.618166
C 8.953677 -0.383659 -1.246463
C -1.051594 0.414191 1.105128
C 10.404286 -0.350101 -0.718425
C -1.602287 1.508030 0.381064
C -1.867776 -0.724809 1.297347
C -2.910895 1.465791 -0.131973
C -3.187516 -0.791676 0.789863
C -3.705406 0.311782 0.071639
C -5.849476 -0.785503 -0.297710
C -7.184210 -0.511435 -0.975089
H 3.814043 0.770225 -0.876338
H 3.748426 -0.974142 -0.551899
H 5.518655 -0.711648 1.240824
H 5.581142 1.035180 0.926943
H 3.068905 1.245708 1.496928
H 3.014974 -0.497447 1.832502
H 6.254502 -1.163991 -1.145334
H 6.323663 0.583618 -1.452864
H 1.236244 -0.790244 0.048125
H 1.298705 0.947306 -0.303720
H 8.094192 0.828785 0.348354
H 8.026202 -0.919662 0.651696
H 0.587854 1.454003 2.069852
H 0.518970 -0.286713 2.421907
H 8.758539 -1.361279 -1.733147
H 8.828238 0.385869 -2.035571
H 10.634655 0.627894 -0.254919
H 11.135883 -0.519952 -1.529883
H 10.564659 -1.130096 0.049885
H -0.996605 2.409027 0.223367
H -1.471194 -1.580967 1.856971
H -3.339872 2.306581 -0.685472
H -3.784167 -1.692284 0.965575
H -6.035294 -0.994554 0.776280
H -5.406039 -1.697388 -0.749341
H -8.889023 -1.479604 -1.215663


