%chk=000022964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022964

0 1
 O   -1.076800      -1.937600      0.1375000    
 O    4.843700     -2.9100001E-02 -0.5425000    
 O   -4.440800      0.3370000     -0.5647000    
 O   -3.361000      -1.878100      0.1366000    
 O    4.087800       1.848400      0.5541000    
 O   -3.523600       2.152100      0.5414000    
 C   0.1781000      0.1440000      8.4299996E-02
 C   0.1504000      -1.246500      0.1200000    
 C    1.415000      0.7934000      6.8000004E-02
 C   -1.080700      0.8727000      6.5300003E-02
 C    2.596900      4.7300000E-02  8.7399997E-02
 C    1.320200      -2.003500      0.1395000    
 C   -2.243700      0.2108000      8.2099997E-02
 C    2.549200      -1.348200      0.1231000    
 C   -2.297200      -1.268000      0.1200000    
 C    3.882900      0.7267000      7.1900003E-02
 C   -3.459400       1.033000      6.1200000E-02
 C    6.158000      0.5336000     -0.6197000    
 C   -5.698900       1.012100     -0.6658000    
 H    1.456600       1.880200      3.7400000E-02
 H   -1.028800       1.956700      3.1700000E-02
 H    1.280800      -3.088100      0.1702000    
 H    3.454400      -1.949000      0.1519000    
 H    6.552500      0.7088000      0.3856000    
 H    6.136400       1.464400      -1.194000    
 H    6.805400     -0.1824000      -1.132700    
 H   -6.398100      0.3517000      -1.185500    
 H   -5.588700       1.933600      -1.245400    
 H   -6.094200       1.227400      0.3315000    


%chk=000022964-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022964

0 1
O -1.039762 -2.005462 -0.071325
O 5.030057 -0.092157 -0.104055
O -4.700002 0.305803 -0.143588
O -3.336766 -2.096041 -0.078377
O 4.045153 2.020318 -0.161582
O -3.458593 2.271100 -0.203936
C 0.187320 0.110524 -0.126254
C 0.161551 -1.318827 -0.086098
C 1.444858 0.770326 -0.139707
C -1.073297 0.801353 -0.150499
C 2.639557 0.025918 -0.114274
C 1.355942 -2.074706 -0.060371
C -2.294472 0.141821 -0.136279
C 2.586737 -1.401239 -0.074602
C -2.368133 -1.330865 -0.095411
C 3.931375 0.770375 -0.129628
C -3.514129 1.013643 -0.165018
C 6.357406 0.567949 -0.116753
C -5.935502 1.128313 -0.169781
H 1.499702 1.864235 -0.169729
H -1.096184 1.897480 -0.181512
H 1.295118 -3.165750 -0.030092
H 3.524975 -1.961736 -0.055478
H 6.466640 1.219407 0.766293
H 6.471805 1.174477 -1.030605
H 7.081586 -0.257972 -0.093986
H -6.751813 0.394494 -0.138847
H -5.970913 1.730913 -1.092731
H -5.963818 1.799708 0.704623


