%chk=000111867.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111867

0 1
 O  -9.3000000E-03  -1.519700     -0.9380000    
 C    1.206400      0.4900000     -0.4977000    
 C   -1.209600      0.4989000     -0.4964000    
 C    1.211800       1.852700     -0.1998000    
 C   -1.204300       1.861700     -0.1985000    
 C  -4.1999999E-03 -0.1869000     -0.6460000    
 C   6.5000001E-03   2.538500     -5.0299998E-02
 C    2.496800     -0.2489000     -0.6583000    
 C   -2.505700     -0.2299000     -0.6568000    
 C    2.494400       2.599700     -3.3000000E-02
 C   -2.481200       2.618700     -3.3300001E-02
 C    2.995900     -0.2306000      -2.108300    
 C   -3.004600     -0.2078000      -2.106800    
 C    2.989600       2.583200       1.419000    
 C   -2.976600       2.608800       1.418700    
 C    4.324200     -0.9549000      -2.257900    
 C   -4.305100     -0.9787000      -2.268600    
 C    4.312300       3.316300       1.574900    
 C   -4.258500       3.409200       1.585500    
 C  -1.1600000E-02  -2.407800      0.1225000    
 C  -8.5000005E-03  -1.929500       1.432900    
 C  -1.6300000E-02  -3.781800     -0.1185000    
 C  -9.8999999E-03  -2.825100       2.502300    
 C  -1.7800000E-02  -4.677200      0.9510000    
 C  -1.4600000E-02  -4.198900       2.261300    
 H   1.0600000E-02   3.599800      0.1874000    
 H    2.397800      -1.290000     -0.3325000    
 H    3.272100      0.1424000      8.1000002E-03
 H   -3.279200      0.1652000      9.2000002E-03
 H   -2.412100      -1.271600     -0.3312000    
 H    2.341300       3.643600     -0.3409000    
 H    3.274400       2.238200     -0.7102000    
 H   -3.265400       2.264800     -0.7094000    
 H   -2.317300       3.660600     -0.3426000    
 H    3.108500      0.7979000      -2.469400    
 H    2.255900     -0.7094000      -2.761600    
 H   -2.248800     -0.6514000      -2.766900    
 H   -3.152800      0.8211000      -2.453100    
 H    2.243000       3.054400       2.070500    
 H    3.108600       1.554700       1.778500    
 H   -3.147700       1.583400       1.764900    
 H   -2.207700       3.033300       2.076300    
 H    5.099700     -0.4795000      -1.649000    
 H    4.236900      -2.001500      -1.949100    
 H    4.651900     -0.9350000      -3.301900    
 H   -4.178700      -2.026500      -1.978100    
 H   -5.097200     -0.5431000      -1.651200    
 H   -4.634100     -0.9529000      -3.312100    
 H    5.093600       2.846500      0.9690000    
 H    4.219400       4.362400       1.266300    
 H    4.635600       3.297800       2.620300    
 H   -4.109600       4.453600       1.293400    
 H   -5.062800       2.991200      0.9720000    
 H   -4.583600       3.391600       2.630500    
 H  -4.8000002E-03 -0.8768000       1.694800    
 H  -1.8600000E-02  -4.159400      -1.137200    
 H  -7.4000000E-03  -2.453700       3.522900    
 H  -2.1400001E-02  -5.747000      0.7635000    
 H  -1.5699999E-02  -4.896200       3.094000    


%chk=000111867-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111867

0 1
O -0.004823 -1.487398 -0.852869
C 1.258830 0.555742 -0.406304
C -1.250729 0.566824 -0.405736
C 1.254863 1.964447 -0.180481
C -1.234301 1.975415 -0.179788
C 0.001184 -0.089374 -0.511601
C 0.013241 2.635889 -0.074991
C 2.541427 -0.239589 -0.599885
C -2.540168 -0.217469 -0.598991
C 2.544813 2.759093 -0.020069
C -2.517231 2.781227 -0.018731
C 2.929697 -0.375308 -2.100031
C -2.928019 -0.353409 -2.099229
C 3.073280 2.760861 1.442889
C -3.046537 2.785113 1.443926
C 4.232712 -1.177806 -2.296353
C -4.237521 -1.145448 -2.294903
C 4.382329 3.563070 1.598091
C -4.349317 3.597356 1.599588
C -0.009145 -2.448882 0.184958
C -0.009604 -2.115072 1.560326
C -0.013099 -3.800798 -0.233430
C -0.014052 -3.154424 2.518630
C -0.017516 -4.824778 0.736368
C -0.018007 -4.509580 2.117389
H 0.018050 3.721789 0.088414
H 2.429619 -1.255330 -0.178668
H 3.376822 0.237950 -0.055104
H -3.372020 0.268641 -0.056401
H -2.437797 -1.233180 -0.175244
H 2.370803 3.808828 -0.327913
H 3.338368 2.367057 -0.684534
H -3.313813 2.397445 -0.684412
H -2.333594 3.829867 -0.324657
H 3.037101 0.635199 -2.542576
H 2.096638 -0.868551 -2.635269
H -2.098589 -0.854951 -2.632377
H -3.026495 0.656894 -2.544290
H 2.290488 3.181306 2.104431
H 3.230844 1.715849 1.776059
H -3.212463 1.740899 1.775474
H -2.260821 3.198428 2.106504
H 5.083197 -0.693323 -1.779546
H 4.131705 -2.201236 -1.888404
H 4.493686 -1.265104 -3.367051
H -4.145382 -2.168772 -1.884628
H -5.084388 -0.652741 -1.779920
H -4.498287 -1.232946 -3.365638
H 5.185949 3.139171 0.966447
H 4.241190 4.618161 1.295870
H 4.736871 3.556258 2.645050
H -4.199797 4.651675 1.298709
H -5.155946 3.180516 0.967072
H -4.704354 3.592034 2.646387
H -0.006497 -1.066277 1.873597
H -0.012589 -4.024351 -1.304741
H -0.014387 -2.898283 3.584259
H -0.020521 -5.871817 0.412941
H -0.021398 -5.308305 2.866486


