%chk=000061418.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061418

0 1
 O  -0.5176000      0.4088000     -0.3657000    
 O   -1.694400      -1.573800     -0.2794000    
 C    1.943600      0.6321000     -0.5166000    
 C    3.094100     -0.3275000     -8.5400000E-02
 C    2.349400     -0.6924000       1.226600    
 C   0.6993000     -0.3064000     -0.4897000    
 C    1.833700       1.601800      0.6941000    
 C   0.9685000      -1.194100      0.7396000    
 C    2.102500      0.6788000       1.894700    
 C    2.110300       1.363800      -1.835200    
 C    3.343100      -1.527200      -1.022100    
 C    4.469200      0.3343000      0.1339000    
 C   -1.656100     -0.3511000     -0.2676000    
 C   -2.857300      0.5579000     -0.1406000    
 C   -4.163700     -0.2289000     -5.0200000E-02
 C   -5.363400      0.7025000      0.1173000    
 C   -6.661300     -7.8599997E-02  0.2462000    
 H    2.860900      -1.404300       1.878700    
 H   0.6494000     -0.9066000      -1.406700    
 H   0.8566000       2.089100      0.7710000    
 H    2.581100       2.401800      0.6478000    
 H    1.027800      -2.248300      0.4478000    
 H   0.2124000      -1.110700       1.527400    
 H    2.980500       1.015500       2.455800    
 H    1.256900      0.6611000       2.590200    
 H    3.006900       1.991900      -1.831900    
 H    2.196500      0.6627000      -2.671500    
 H    1.250700       2.013200      -2.032800    
 H    3.776500      -1.192200      -1.971300    
 H    4.051300      -2.226600     -0.5623000    
 H    2.452500      -2.107400      -1.270800    
 H    4.909600      0.6364000     -0.8232000    
 H    4.448500       1.225900      0.7639000    
 H    5.159800     -0.3715000      0.6099000    
 H   -2.727100       1.166300      0.7615000    
 H   -2.882500       1.216700      -1.015800    
 H   -4.290900     -0.8403000     -0.9524000    
 H   -4.116600     -0.9245000      0.7972000    
 H   -5.432500       1.378500     -0.7429000    
 H   -5.230400       1.325200       1.009600    
 H   -6.840900     -0.6902000     -0.6437000    
 H   -6.636600     -0.7395000       1.118600    
 H   -7.506300      0.6071000      0.3635000    


%chk=000061418-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000061418

0 1
O -0.526564 0.335988 0.030859
O -1.741144 -1.569036 -0.557955
C 1.909299 0.593430 -0.450331
C 3.156045 -0.333872 -0.104625
C 2.622687 -0.662759 1.340203
C 0.747963 -0.412811 -0.197220
C 1.915005 1.601344 0.748849
C 1.199894 -1.230947 1.055649
C 2.429787 0.750492 1.965054
C 1.871406 1.254815 -1.830278
C 3.314261 -1.576068 -1.018323
C 4.510668 0.413708 -0.121671
C -1.713180 -0.371235 -0.190761
C -2.918554 0.515119 0.085143
C -4.261729 -0.182056 -0.206076
C -5.474093 0.712994 0.132888
C -6.821423 0.014136 -0.151076
H 3.262530 -1.337115 1.934951
H 0.570399 -1.064212 -1.070343
H 0.906142 2.011953 0.916808
H 2.585993 2.451594 0.530363
H 1.204142 -2.313125 0.843905
H 0.514818 -1.061731 1.905113
H 3.377244 1.148247 2.370460
H 1.702599 0.725401 2.796339
H 2.741181 1.921630 -1.977150
H 1.873943 0.504827 -2.644038
H 0.957563 1.867026 -1.943602
H 3.522936 -1.266818 -2.060226
H 4.172829 -2.186567 -0.679925
H 2.430826 -2.235928 -1.037108
H 4.809100 0.652602 -1.160051
H 4.500915 1.357667 0.447864
H 5.302005 -0.229238 0.308871
H -2.866840 0.838287 1.144280
H -2.812193 1.441457 -0.512466
H -4.299862 -0.477006 -1.272529
H -4.317421 -1.124642 0.371388
H -5.415089 1.654514 -0.451052
H -5.428211 1.006394 1.202006
H -6.906672 -0.262427 -1.218813
H -6.917671 -0.913972 0.443119
H -7.677536 0.667242 0.099007


