%chk=000127494.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127494

0 1
 O    4.609700     -4.6999999E-03  0.7078000    
 O  -6.2799998E-02 -0.6882000       2.729200    
 O    4.531900       2.238800      4.8099998E-02
 O    2.692300       2.119500      -1.292700    
 O   -5.248900       2.028400     -0.9386000    
 C    2.171300     -0.3478000      0.4907000    
 C    1.316600     -0.5667000     -0.7738000    
 C  -8.3800003E-02  -1.125900     -0.4796000    
 C  -0.8467000     -9.9900000E-02  0.4376000    
 C   -2.344500     -0.5288000      0.6794000    
 C    3.498300      0.1327000     -0.1619000    
 C    1.443400      0.6658000       1.398200    
 C  -2.5300000E-02  0.2924000       1.703300    
 C    2.246600      -1.346900      -1.699500    
 C    3.645200     -0.7614000      -1.416200    
 C  -0.8463000      -1.394600      -1.795500    
 C    2.465700      -1.651600       1.285900    
 C   -2.954200     -0.6810000     -0.7203000    
 C   -2.319200      -1.742400      -1.582500    
 C   -3.152400      0.5124000       1.504100    
 C   -2.488800      -1.866500       1.448000    
 C    3.501600       1.588900     -0.5464000    
 C   -3.533200       1.751000      0.7135000    
 C   -3.891200      0.1317000      -1.235500    
 C   -4.325300       1.344700     -0.5032000    
 H    1.136700      0.3974000      -1.267400    
 H   1.1500000E-02  -2.082500      4.4000000E-02
 H  -0.8888000      0.8311000     -0.1519000    
 H    1.418400       1.650200      0.9176000    
 H    2.005400      0.7918000       2.332000    
 H  -0.4858000       1.188300       2.136400    
 H    1.974400      -1.224100      -2.752900    
 H    2.227900      -2.419400      -1.476700    
 H    4.367300      -1.570900      -1.258300    
 H    3.995000     -0.1890000      -2.283400    
 H  -0.3661000      -2.214700      -2.342500    
 H  -0.7821000     -0.5090000      -2.442400    
 H    3.014200      -1.425100       2.207600    
 H    1.555000      -2.179300       1.578000    
 H    3.071900      -2.366100      0.7199000    
 H   -2.421100      -2.729700      -1.120100    
 H   -2.811900      -1.814000      -2.560000    
 H   -2.617500      0.8018000       2.414500    
 H   -4.086900      4.7200002E-02   1.852600    
 H   -2.282300      -1.741200       2.515900    
 H   -3.512000      -2.255400       1.370400    
 H   -1.820000      -2.649200       1.080700    
 H    5.420700      0.1012000      0.1813000    
 H   -2.656300       2.323200      0.3958000    
 H   -4.159300       2.399700       1.336000    
 H   0.4164000     -0.3350000       3.497800    
 H   -4.285800     -4.4999998E-03  -2.236500    
 H    4.551500       3.190000     -0.1907000    


%chk=000127494-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127494

0 1
O 4.593850 -0.070929 0.875026
O -0.148576 -0.741545 2.707941
O 4.767968 2.214665 -0.288830
O 2.674495 2.185831 -1.274888
O -5.226796 2.205913 -0.910586
C 2.146479 -0.321058 0.499321
C 1.311171 -0.582485 -0.790024
C -0.092872 -1.150929 -0.488953
C -0.857024 -0.124360 0.416057
C -2.358906 -0.575838 0.681327
C 3.531162 0.133592 -0.108008
C 1.403524 0.722303 1.365073
C -0.067041 0.321808 1.677510
C 2.273537 -1.383283 -1.705415
C 3.690597 -0.810656 -1.376586
C -0.862057 -1.401245 -1.813627
C 2.415613 -1.620993 1.309983
C -2.979452 -0.677087 -0.721037
C -2.371995 -1.736153 -1.614185
C -3.155592 0.442544 1.549574
C -2.467625 -1.958203 1.398148
C 3.546282 1.586499 -0.610669
C -3.543005 1.740363 0.812313
C -3.912863 0.211744 -1.193245
C -4.326199 1.429339 -0.465002
H 1.152676 0.403820 -1.273960
H 0.010744 -2.110307 0.054373
H -0.927181 0.807573 -0.191224
H 1.367001 1.691630 0.830214
H 1.942859 0.899551 2.319434
H -0.565641 1.226502 2.090314
H 2.020447 -1.261044 -2.772518
H 2.225908 -2.464578 -1.475855
H 4.405180 -1.599824 -1.086065
H 4.123267 -0.272280 -2.238714
H -0.376947 -2.221706 -2.376141
H -0.789124 -0.489567 -2.442381
H 3.047952 -1.391093 2.183613
H 1.468664 -2.056613 1.663412
H 2.957474 -2.374157 0.712913
H -2.465030 -2.740631 -1.160233
H -2.880818 -1.764414 -2.594754
H -2.592217 0.665909 2.472837
H -4.089343 -0.058580 1.874239
H -2.152936 -1.852228 2.447294
H -3.515655 -2.311972 1.365357
H -1.833190 -2.736391 0.943257
H 5.326965 0.570929 0.686708
H -2.640374 2.317563 0.521946
H -4.154153 2.404600 1.448655
H 0.502262 -0.527876 3.423842
H -4.348477 0.083755 -2.193030
H 4.785413 3.134290 -0.666948


