%chk=000086843.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086843

0 1
 O    5.077600      0.7892000      0.3029000    
 O   -5.567300     -0.1106000      0.7649000    
 C    2.006700     -0.8995000     -0.2494000    
 C   0.4964000     -0.7762000     -0.5400000    
 C    2.788100      0.4220000     -0.4438000    
 C  -0.1690000      0.4460000      0.1249000    
 C    2.077900       1.629100      0.1872000    
 C   0.6092000       1.730800     -0.2081000    
 C   -1.664200      0.5787000     -0.3040000    
 C    2.383700      -1.340600       1.172500    
 C  -0.2654000      -2.060100     -0.1705000    
 C    4.045300      0.1323000      0.3668000    
 C    3.879500      -1.063000       1.269800    
 C   -2.377300     -0.7537000     -0.4797000    
 C    3.133300      0.6626000      -1.913700    
 C   -2.433200       1.440700      0.7236000    
 C   -1.740100      -1.932200     -0.3864000    
 C   -3.844900     -0.6913000     -0.8008000    
 C   -3.911800       1.581700      0.3842000    
 C   -4.524600      0.2140000      0.1996000    
 H    2.412000      -1.660700     -0.9339000    
 H   0.4002000     -0.6414000      -1.628600    
 H  -0.1331000      0.3016000       1.214000    
 H    2.593300       2.557100     -9.1899998E-02
 H    2.140500       1.581600       1.282900    
 H   0.1722000       2.588000      0.3153000    
 H   0.5321000       1.949000      -1.280300    
 H   -1.702600       1.085300      -1.278900    
 H    2.175200      -2.400200       1.350700    
 H    1.843200     -0.7619000       1.930000    
 H  -0.1048000      -2.336400      0.8774000    
 H   0.1119000      -2.886200     -0.7851000    
 H    4.466000      -1.894300      0.8682000    
 H    4.183000     -0.8317000       2.292900    
 H    3.734400     -0.1595000      -2.319100    
 H    2.234900      0.7572000      -2.531500    
 H    3.723600       1.577900      -2.035800    
 H   -1.996700       2.442900      0.7881000    
 H   -2.340900      0.9890000       1.720800    
 H   -2.295500      -2.859500     -0.5007000    
 H   -4.002400     -0.2810000      -1.803900    
 H   -4.316900      -1.678900     -0.7577000    
 H   -4.053700       2.152700     -0.5394000    
 H   -4.433800       2.104500       1.192400    


%chk=000086843-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086843

0 1
O 5.174884 0.825391 0.204868
O -5.723995 -0.082273 0.671014
C 2.010660 -0.921900 -0.237572
C 0.493468 -0.807022 -0.548967
C 2.826031 0.387463 -0.491990
C -0.170270 0.429245 0.114776
C 2.103248 1.615834 0.170122
C 0.620675 1.712972 -0.244125
C -1.672289 0.571705 -0.279197
C 2.389127 -1.330355 1.222982
C -0.268120 -2.100858 -0.174121
C 4.115021 0.165961 0.332868
C 3.890549 -0.973034 1.338872
C -2.386107 -0.759694 -0.502989
C 3.148652 0.671447 -1.972534
C -2.449440 1.386528 0.799988
C -1.757401 -1.962009 -0.414785
C -3.873561 -0.658954 -0.825472
C -3.945462 1.586095 0.441003
C -4.627401 0.251025 0.152694
H 2.424184 -1.706025 -0.910048
H 0.391031 -0.675666 -1.649101
H -0.126858 0.290336 1.217935
H 2.653111 2.534069 -0.108963
H 2.158511 1.541368 1.275568
H 0.166751 2.595982 0.246805
H 0.542749 1.887074 -1.337022
H -1.728784 1.153492 -1.229627
H 2.201039 -2.399744 1.417166
H 1.797913 -0.754254 1.958987
H -0.081987 -2.356045 0.890537
H 0.127601 -2.953668 -0.762474
H 4.529920 -1.821975 1.021887
H 4.229141 -0.684618 2.349226
H 3.548497 -0.230235 -2.472425
H 2.254032 0.998778 -2.531106
H 3.915125 1.463792 -2.043841
H -1.975837 2.376235 0.940091
H -2.377281 0.850280 1.767133
H -2.340702 -2.884863 -0.542219
H -3.994784 -0.203743 -1.834466
H -4.360680 -1.648344 -0.846343
H -4.015344 2.210225 -0.475072
H -4.493617 2.104982 1.245835


