%chk=000068593.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068593

0 1
 O    7.210200      -1.598800      0.1832000    
 O    6.356800       1.698600      0.5552000    
 O    7.272900      0.8385000      -1.386300    
 C    6.186600     -0.5967000      0.1300000    
 C    4.892000      -1.101500     -0.4297000    
 C    6.672700      -1.155200       1.435800    
 C    3.665400     -0.3820000      0.1370000    
 C    2.343500     -0.9522000     -0.3867000    
 C    6.670000      0.7133000     -0.3300000    
 C    1.110600     -0.2303000      0.1668000    
 C  -0.2104000     -0.7816000     -0.3745000    
 C   -1.405500     -5.2000000E-03  0.1851000    
 C   -2.727800     -0.5811000     -0.3258000    
 C   -3.958700      0.1640000      0.1987000    
 C   -5.312700     -0.3554000     -0.2961000    
 C   -6.548700      0.3520000      0.2700000    
 C   -7.864800     -0.1593000     -0.3210000    
 C   -9.104100      0.4845000      0.3096000    
 C   -10.42210     -4.4100001E-02 -0.2577000    
 C    6.789700       3.012700      0.1894000    
 C   -11.61540      0.6799000      0.3472000    
 H    4.905100     -0.9944000      -1.521700    
 H    4.791400      -2.177100     -0.2324000    
 H    6.039700      -1.844600       1.980300    
 H    7.311500     -0.5470000       2.063900    
 H    3.678300     -0.4478000       1.232000    
 H    3.721100      0.6852000     -0.1105000    
 H    2.334700     -0.8895000      -1.481800    
 H    2.281700      -2.016700     -0.1292000    
 H    1.113400     -0.3047000       1.261400    
 H    1.183200      0.8367000     -7.8100003E-02
 H  -0.2989000      -1.841700     -0.1080000    
 H  -0.2124000     -0.7214000      -1.469500    
 H   -1.328200       1.049900     -0.1037000    
 H   -1.390800     -4.3200001E-02   1.281000    
 H   -2.736100     -0.5521000      -1.422400    
 H   -2.801100      -1.636800     -3.6699999E-02
 H   -3.950500      0.1247000       1.295300    
 H   -3.873100       1.223900     -7.2499998E-02
 H   -5.384100      -1.425000     -6.1200000E-02
 H   -5.332600     -0.2784000      -1.390500    
 H   -6.563300      0.2218000       1.359000    
 H   -6.465100       1.429200      8.1100002E-02
 H   -7.871100      2.4800001E-02  -1.402300    
 H   -7.921100      -1.246400     -0.1845000    
 H   -9.053500       1.570100      0.1587000    
 H   -9.085600      0.3154000       1.393500    
 H   -10.43650      8.6700000E-02  -1.345800    
 H   -10.50760      -1.118300     -5.7999998E-02
 H    6.479700       3.704400      0.9772000    
 H    6.320100       3.317800     -0.7507000    
 H    7.880200       3.042500      0.1047000    
 H   -11.64530      0.5470000       1.433400    
 H   -11.57410       1.752600      0.1327000    
 H   -12.54800      0.2862000     -6.9100000E-02


%chk=000068593-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000068593

0 1
O 7.330739 -1.447073 0.188544
O 7.607978 1.447611 0.467322
O 6.005439 1.529944 -1.219694
C 6.158992 -0.466197 0.196238
C 4.850666 -0.996515 -0.364107
C 6.717842 -1.000123 1.485344
C 3.610315 -0.292063 0.238225
C 2.286835 -0.849183 -0.331400
C 6.553353 0.920429 -0.271391
C 1.036264 -0.157089 0.254640
C -0.288958 -0.701390 -0.324446
C -1.542277 -0.010562 0.258548
C -2.866539 -0.551506 -0.325965
C -4.121478 0.136808 0.256689
C -5.444794 -0.403642 -0.330488
C -6.700934 0.281555 0.253365
C -8.023555 -0.260171 -0.334583
C -9.280868 0.421652 0.250801
C -10.602914 -0.121591 -0.338234
C 8.120352 2.759875 0.004399
C -11.854096 0.563526 0.252994
H 4.848394 -0.867829 -1.462442
H 4.806766 -2.082622 -0.156699
H 6.137341 -1.771226 2.008762
H 7.363572 -0.364031 2.099070
H 3.614478 -0.408655 1.341817
H 3.666887 0.793563 0.027423
H 2.288198 -0.730365 -1.434690
H 2.229546 -1.940526 -0.135009
H 1.031449 -0.278598 1.358271
H 1.098554 0.934308 0.062136
H -0.350973 -1.793588 -0.134545
H -0.283441 -0.578170 -1.427707
H -1.478978 1.081925 0.071148
H -1.550387 -0.136195 1.361710
H -2.858505 -0.424370 -1.428892
H -2.928951 -1.644459 -0.140464
H -4.130743 0.008424 1.359530
H -4.058816 1.229919 0.072373
H -5.506146 -1.497204 -0.148174
H -5.436155 -0.273437 -1.433093
H -6.709878 0.151247 1.355974
H -6.640208 1.375119 0.071069
H -8.015432 -0.127927 -1.436998
H -8.082897 -1.354203 -0.154231
H -9.223607 1.515796 0.070525
H -9.290875 0.289429 1.353210
H -10.592294 0.011953 -1.439424
H -10.658497 -1.214885 -0.158982
H 8.900999 3.027889 0.729437
H 7.307679 3.505356 -0.005260
H 8.538076 2.663490 -1.011662
H -11.903535 0.419735 1.349034
H -11.837672 1.652907 0.059352
H -12.785012 0.156837 -0.183570


