%chk=000173764.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173764

0 1
 O    8.437400      -1.541900     -0.2104000    
 O    6.258100      -2.188700     -0.3309000    
 C    1.402200      0.5666000      0.4107000    
 C    2.662400      0.6543000     -0.4535000    
 C   0.1469000      0.4311000     -0.4532000    
 C    3.916600      0.8238000      0.4073000    
 C   -1.150000      0.3711000      0.3599000    
 C    5.172400      0.9428000     -0.4613000    
 C   -2.434300      0.1498000     -0.4452000    
 C    6.479700       1.023200      0.3521000    
 C   -3.700500      0.1550000      0.4134000    
 C   -4.949500     -7.8100003E-02 -0.4396000    
 C   -6.220300     -3.6200002E-02  0.4122000    
 C   -7.469900     -0.2374000     -0.4472000    
 C    6.873600     -0.2897000       1.045300    
 C    7.613400       1.546200     -0.5367000    
 C   -8.775600     -0.1731000      0.3514000    
 C   -10.06130     -0.3456000     -0.4608000    
 C    7.121600      -1.437000      9.8600000E-02
 C   -11.32300     -0.3366000      0.3879000    
 H    1.319800       1.465000       1.034400    
 H    1.477000     -0.2924000       1.088100    
 H    2.753600     -0.2523000      -1.064000    
 H    2.575300       1.502300      -1.143700    
 H   8.8500001E-02   1.276000      -1.150400    
 H   0.2264000     -0.4771000      -1.063300    
 H    4.002300     -3.7200000E-02   1.079000    
 H    3.820400       1.717400       1.035500    
 H   -1.246800       1.304500      0.9290000    
 H   -1.063200     -0.4339000       1.101000    
 H    5.217900      0.1114000      -1.173900    
 H    5.073000       1.853900      -1.066400    
 H   -2.512500      0.9331000      -1.209400    
 H   -2.358800     -0.8057000     -0.9787000    
 H    6.333900       1.770600       1.143900    
 H   -3.627100     -0.6248000       1.180800    
 H   -3.783100       1.116200      0.9351000    
 H   -4.875600      -1.049200     -0.9439000    
 H   -5.007300      0.6891000      -1.221400    
 H   -6.285100      0.9287000      0.9296000    
 H   -6.175200     -0.8147000       1.183000    
 H   -7.498000      0.5290000      -1.231800    
 H   -7.409800      -1.207800     -0.9550000    
 H    7.773600     -0.1391000       1.655200    
 H    6.100000     -0.6081000       1.753200    
 H    7.770800      0.9050000      -1.410100    
 H    8.553600       1.603200      2.1900000E-02
 H    7.384200       2.553500     -0.9012000    
 H   -8.820700      0.7896000      0.8764000    
 H   -8.745200     -0.9468000       1.129300    
 H   -10.01430      -1.291500      -1.013100    
 H   -10.12680      0.4548000      -1.207100    
 H   -11.42170      0.6093000      0.9297000    
 H   -11.30760      -1.151200       1.118800    
 H   -12.20760     -0.4619000     -0.2441000    
 H    8.611500      -2.288200     -0.8226000    


%chk=000173764-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173764

0 1
O 8.551594 -1.649898 0.388478
O 6.332150 -2.059718 -0.142735
C 1.432351 0.448217 0.291876
C 2.704357 0.709392 -0.545430
C 0.134736 0.430916 -0.547210
C 3.998039 0.716282 0.300526
C -1.136830 0.204399 0.301157
C 5.266439 0.965418 -0.545824
C -2.438729 0.180965 -0.531155
C 6.571771 1.158587 0.270653
C -3.710622 0.014913 0.330787
C -5.016758 -0.013172 -0.494602
C -6.287857 -0.120644 0.377832
C -7.597348 -0.151808 -0.442383
C 6.917585 -0.058649 1.195580
C 7.760113 1.515939 -0.652241
C -8.867515 -0.221815 0.435297
C -10.178521 -0.256707 -0.383288
C 7.180585 -1.333816 0.425912
C -11.441516 -0.311058 0.503466
H 1.346624 1.225918 1.080109
H 1.537449 -0.521226 0.822436
H 2.791044 -0.066720 -1.333923
H 2.603213 1.681276 -1.073071
H 0.040582 1.391198 -1.096788
H 0.208840 -0.362861 -1.319735
H 4.083996 -0.258426 0.820754
H 3.914672 1.496375 1.087646
H -1.209574 1.003916 1.068452
H -1.040874 -0.751289 0.858017
H 5.396128 0.127366 -1.258843
H 5.116571 1.880086 -1.156707
H -2.515461 1.121265 -1.116779
H -2.385737 -0.643161 -1.273106
H 6.409437 2.008269 0.967879
H -3.632509 -0.919825 0.924879
H -3.762071 0.845548 1.066018
H -4.984579 -0.865778 -1.204938
H -5.076836 0.905512 -1.115458
H -6.318952 0.736727 1.082785
H -6.226837 -1.034839 1.005008
H -7.647239 0.751543 -1.086217
H -7.578571 -1.022498 -1.131042
H 7.806684 0.185036 1.800394
H 6.068253 -0.248388 1.875291
H 7.945428 0.717051 -1.394644
H 8.692863 1.660094 -0.076854
H 7.550895 2.448054 -1.208630
H -8.888192 0.652004 1.120097
H -8.818104 -1.122009 1.083470
H -10.161489 -1.135322 -1.060216
H -10.222290 0.638068 -1.037613
H -11.498346 0.574081 1.165075
H -11.433937 -1.210204 1.148435
H -12.364769 -0.338820 -0.104333
H 8.674959 -2.485467 -0.140743


