%chk=000158573.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158573

0 1
 O   -5.241800       1.641600      0.2408000    
 O   -8.068200       1.090700     -5.9000000E-02
 O   -9.832200     -0.9370000      0.6312000    
 C   -1.203200     -0.1025000     -0.5413000    
 C   -2.497100      0.2122000      0.2178000    
 C   6.0600001E-02  0.1438000      0.2864000    
 C    1.356200     -0.1021000     -0.4945000    
 C   -3.765700     -5.3300001E-02 -0.6018000    
 C    2.658500      0.1514000      0.2723000    
 C   -5.042600      0.2313000      0.2020000    
 C    3.949100     -3.2200001E-02 -0.5328000    
 C   -6.255600     -0.4616000     -0.4426000    
 C    5.215600      0.1869000      0.2986000    
 C    6.506400      9.4999997E-03 -0.5087000    
 C   -7.572400     -0.1977000      0.3011000    
 C    7.773700      0.1526000      0.3415000    
 C   -8.626700      -1.239400     -6.3100003E-02
 C    9.066900     -1.5400000E-02 -0.4646000    
 C    10.30850      0.1454000      0.3632000    
 C    11.21010     -0.8242000      0.5535000    
 H   -1.220300      -1.149700     -0.8674000    
 H   -1.165500      0.5116000      -1.449600    
 H   -2.474100       1.262300      0.5319000    
 H   -2.526400     -0.3918000       1.133200    
 H   4.6100002E-02 -0.5030000       1.172000    
 H   5.7200000E-02   1.178600      0.6501000    
 H   -3.752100      -1.104000     -0.9159000    
 H   -3.744700      0.5647000      -1.507800    
 H    1.351600      0.5356000      -1.387800    
 H    1.359700      -1.138200     -0.8559000    
 H    2.636800       1.173900      0.6700000    
 H    2.684200     -0.5176000       1.141800    
 H   -4.938800     -0.1272000       1.233000    
 H    3.965700      -1.044400     -0.9553000    
 H    3.945400      0.6648000      -1.379500    
 H   -6.058900      -1.540400     -0.4680000    
 H   -6.357300     -0.1111000      -1.478100    
 H    5.217600     -0.5179000       1.139400    
 H    5.197000       1.195200      0.7300000    
 H    6.528000      0.7479000      -1.319600    
 H    6.503100     -0.9808000     -0.9806000    
 H   -7.424700     -0.2011000       1.387200    
 H    7.771200       1.138700      0.8234000    
 H    7.750500     -0.5913000       1.148100    
 H   -8.303400      -2.246600      0.2177000    
 H   -8.847200      -1.212700      -1.135400    
 H   -4.522800       2.030100      0.7667000    
 H    9.093100      0.7327000      -1.266400    
 H    9.058500     -0.9966000     -0.9555000    
 H   -7.399000       1.746000      0.2016000    
 H    10.47750       1.114200      0.8259000    
 H   -10.48320      -1.614000      0.3791000    
 H    12.09000     -0.6441000       1.161300    
 H    11.08870      -1.807100      0.1118000    


%chk=000158573-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000158573

0 1
O -5.264266 1.252209 0.684937
O -7.924400 1.141386 0.439272
O -10.117920 -0.392319 0.224351
C -1.209287 -0.324243 -0.485769
C -2.507729 -0.035954 0.301867
C 0.072504 0.037701 0.297167
C 1.370490 -0.248236 -0.491080
C -3.785398 -0.380949 -0.497162
C 2.652601 0.116693 0.290680
C -5.093263 -0.178718 0.291603
C 3.951608 -0.164308 -0.497648
C -6.353857 -0.538853 -0.513527
C 5.232772 0.200918 0.285755
C 6.532597 -0.078581 -0.501657
C -7.661275 -0.299854 0.269019
C 7.810909 0.289288 0.284518
C -8.905026 -0.830878 -0.462565
C 9.113157 0.003995 -0.511048
C 10.360838 0.427581 0.235034
C 11.396337 -0.384436 0.566838
H -1.180994 -1.399188 -0.760899
H -1.228870 0.240972 -1.440445
H -2.511214 1.040766 0.578947
H -2.495967 -0.611334 1.251709
H 0.091806 -0.528202 1.252064
H 0.042684 1.112789 0.573100
H -3.736921 -1.442173 -0.816560
H -3.826306 0.232611 -1.418850
H 1.351113 0.316907 -1.446348
H 1.403087 -1.323193 -0.766647
H 2.618786 1.191114 0.568586
H 2.673614 -0.450225 1.244967
H -5.061885 -0.789889 1.222364
H 3.986259 -1.238525 -0.776068
H 3.931517 0.403183 -1.451614
H -6.285006 -1.605898 -0.805888
H -6.377131 0.062967 -1.442894
H 5.253088 -0.366628 1.239539
H 5.197679 1.275046 0.564601
H 6.513434 0.488883 -1.455870
H 6.569255 -1.152665 -0.779918
H -7.595054 -0.780360 1.271716
H 7.777940 1.364688 0.557620
H 7.838821 -0.274512 1.238343
H -8.926331 -1.934648 -0.459687
H -8.890291 -0.466662 -1.513712
H -4.499495 1.544749 1.238224
H 9.057892 0.551499 -1.476624
H 9.170693 -1.073925 -0.759060
H -7.044327 1.563903 0.661825
H 10.402272 1.489570 0.528262
H -9.956428 0.562392 0.457226
H 12.269788 -0.010942 1.113490
H 11.398702 -1.448810 0.299317


