%chk=000155258.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155258

0 1
 O   0.2489000       2.263400     -0.2997000    
 O    1.758500      -2.285300      0.8276000    
 O    2.034000       3.594700      0.2840000    
 C   -2.588100       1.999800      0.2499000    
 C   -3.984400       1.492500     -0.1211000    
 C   -1.993100       2.953200     -0.7850000    
 C   -4.590000      0.5577000      0.9267000    
 C  -0.5933000       3.404400     -0.3895000    
 C   -5.942800      2.5400000E-02  0.4787000    
 C    1.544300       2.501200      4.7400001E-02
 C    2.315700       1.233900      0.1047000    
 C    1.659300      6.8300001E-02  0.4438000    
 C    2.383700      -1.122500      0.4967000    
 C    3.664800       1.260400     -0.1839000    
 C    3.748700      -1.121900      0.2094000    
 C    4.389100      6.9600001E-02 -0.1310000    
 C   0.5370000      -2.551500      0.2317000    
 C   0.3900000      -2.340500      -1.127300    
 C  -0.5045000      -3.021300       1.011200    
 C  -0.8402000      -2.608700      -1.727300    
 C   -1.734800      -3.289500      0.4110000    
 C   -1.902700      -3.083200     -0.9582000    
 H   -2.638300       2.507700       1.221100    
 H   -1.929800       1.132500      0.3817000    
 H   -3.926600      0.9686000      -1.083500    
 H   -4.652100       2.350600     -0.2678000    
 H   -1.947400       2.439200      -1.752800    
 H   -2.640900       3.829000     -0.9032000    
 H   -3.913800     -0.2863000       1.106000    
 H   -4.704400       1.090500       1.877600    
 H  -0.2027000       4.088700      -1.151300    
 H  -0.6211000       3.922600      0.5762000    
 H   -5.851900     -0.5432000     -0.4523000    
 H   -6.651400      0.8434000      0.3149000    
 H   -6.360100     -0.6384000       1.242300    
 H   0.6049000      7.7200003E-02  0.7052000    
 H    4.173900       2.181000     -0.4536000    
 H    4.318000      -2.046500      0.2482000    
 H    5.451700      6.9799997E-02 -0.3558000    
 H    1.208100      -1.994200      -1.752100    
 H  -0.3756000      -3.181500       2.077300    
 H  -0.9698000      -2.452700      -2.794200    
 H   -2.562400      -3.657900       1.010100    
 H   -2.860600      -3.292100      -1.425400    


%chk=000155258-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155258

0 1
O 0.157321 2.224938 -0.497666
O 1.866706 -2.436911 0.647414
O 1.992966 3.649309 -0.320116
C -2.742823 2.307194 0.272672
C -4.186773 1.797871 0.067782
C -2.124083 2.891497 -1.016805
C -4.808699 1.203670 1.352210
C -0.695383 3.404692 -0.837662
C -6.250525 0.692622 1.142469
C 1.505481 2.492664 -0.254776
C 2.273044 1.256406 0.084441
C 1.642144 -0.011500 0.147382
C 2.416385 -1.143761 0.477930
C 3.659019 1.386297 0.356006
C 3.797852 -1.027051 0.756138
C 4.411970 0.242593 0.695200
C 0.725579 -2.857925 -0.086517
C 0.535026 -2.540027 -1.451481
C -0.165946 -3.713462 0.596037
C -0.578587 -3.083169 -2.130153
C -1.271788 -4.252579 -0.097374
C -1.485617 -3.937591 -1.460117
H -2.734731 3.082543 1.067337
H -2.105320 1.477911 0.636070
H -4.194344 1.026488 -0.730722
H -4.826081 2.629680 -0.296739
H -2.137035 2.128252 -1.819454
H -2.741640 3.741004 -1.374762
H -4.169100 0.373038 1.713970
H -4.799667 1.973279 2.150925
H -0.291764 3.865514 -1.757753
H -0.612058 4.139848 -0.015513
H -6.281161 -0.099785 0.370770
H -6.917101 1.510473 0.809018
H -6.671516 0.272819 2.074573
H 0.570492 -0.091855 -0.049489
H 4.115936 2.378893 0.299841
H 4.362150 -1.926996 1.018189
H 5.481533 0.335325 0.910186
H 1.245218 -1.892897 -1.975613
H 0.020998 -3.944553 1.648956
H -0.729668 -2.843292 -3.188459
H -1.965947 -4.916971 0.428746
H -2.344663 -4.356397 -1.994689


