%chk=000041894.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041894

0 1
 O    3.083000       1.464800      -1.341300    
 O    5.239800       1.301100      0.2865000    
 C    1.657800      0.1705000      3.6200002E-02
 C  -0.7448000     -0.3126000      1.0500000E-02
 C   0.3111000      0.6362000      4.2300001E-02
 C    2.845200       1.119000      2.5100000E-02
 C    1.923700      -1.215600     -3.6699999E-02
 C   -2.102600      0.1107000      2.7200000E-02
 C  -0.4597000      -1.697200     -4.6100002E-02
 C    4.113900      0.5073000      0.6497000    
 C   0.8693000      -2.131100     -7.8100003E-02
 C   -2.417100       1.486900      6.9100000E-02
 C   -3.151100     -0.8407000     -8.9999998E-04
 C  -4.5699999E-02   2.001600      7.0699997E-02
 C    3.303900      -1.716400     -8.5900001E-02
 C    4.329000     -0.9191000      0.2395000    
 C   -1.509900      -2.624200     -7.5400002E-02
 C   -1.378700       2.419000      8.7099999E-02
 C   -2.838100      -2.202500     -5.0700001E-02
 C   -3.759200       1.894500      8.7700002E-02
 C   -4.484300     -0.4055000      1.9400001E-02
 C   -4.785400      0.9534000      6.4099997E-02
 H    2.629000       2.045000      0.5670000    
 H    4.038700      0.5242000       1.744400    
 H    1.085500      -3.197800     -0.1316000    
 H   0.7113000       2.781600      7.7200003E-02
 H    3.476000      -2.753500     -0.3532000    
 H    5.338100      -1.320300      0.2464000    
 H   -1.304700      -3.692300     -0.1183000    
 H   -1.590900       3.486000      0.1126000    
 H   -3.625800      -2.952800     -7.4000001E-02
 H   -4.017400       2.951000      0.1201000    
 H   -5.302100      -1.122900     -6.9999998E-04
 H    3.857400       2.052400      -1.362300    
 H   -5.821400       1.279600      7.8900002E-02
 H    5.083000       2.200700      0.6209000    


%chk=000041894-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041894

0 1
O 3.054969 1.601021 -1.321297
O 5.282283 1.371096 0.219437
C 1.659002 0.168748 0.054534
C -0.771047 -0.336047 0.010999
C 0.309591 0.626092 0.043899
C 2.822027 1.152857 0.066333
C 1.939367 -1.229367 -0.030764
C -2.139651 0.102058 0.030014
C -0.474106 -1.746076 -0.053140
C 4.126596 0.542278 0.651537
C 0.879450 -2.161780 -0.089326
C -2.449091 1.510201 0.068439
C -3.212736 -0.863645 0.005125
C -0.037210 2.035461 0.048360
C 3.336373 -1.696612 -0.082909
C 4.381710 -0.870293 0.189232
C -1.566751 -2.694489 -0.083619
C -1.353982 2.455573 0.064930
C -2.882821 -2.271275 -0.051133
C -3.807491 1.924570 0.092413
C -4.558698 -0.406693 0.032025
C -4.850407 0.973007 0.077108
H 2.570469 2.040824 0.687200
H 4.053849 0.556512 1.762410
H 1.108973 -3.232613 -0.156923
H 0.764256 2.777932 0.004469
H 3.512689 -2.746609 -0.345783
H 5.425001 -1.199529 0.150372
H -1.327519 -3.763269 -0.131998
H -1.590633 3.526203 0.062560
H -3.702459 -2.999108 -0.071495
H -4.040048 2.995528 0.119850
H -5.372840 -1.140743 0.015026
H 4.035853 1.780234 -1.382736
H -5.893017 1.308395 0.096405
H 5.324848 2.190561 0.775846


