%chk=000052653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052653

0 1
 O   -2.755800     -0.4388000       1.029500    
 O    2.745700     -0.4365000      -1.032200    
 O   -2.210400     -0.4334000      -1.245500    
 O    2.235700     -0.4353000       1.251900    
 C   -6.112100      0.7865000      0.1779000    
 C    6.101900      0.7876000     -0.1794000    
 C   -6.796400     -0.4393000     -3.9999999E-04
 C    6.786400     -0.4385000     -3.1999999E-03
 C   -4.751100      0.7693000      0.5242000    
 C    4.740900      0.7709000     -0.5253000    
 C   -6.099600      -1.646300      0.1731000    
 C    6.089700      -1.645200     -0.1786000    
 C   -4.074600     -0.4391000      0.6928000    
 C    4.099600     -0.4373000     -0.6869000    
 C   -6.808600       1.993500      3.8999999E-03
 C    6.798300       1.994400     -3.5999999E-03
 C   -8.157400     -0.4220000     -0.3467000    
 C    8.147500     -0.4216000      0.3428000    
 C   -4.747600      -1.644600      0.5176000    
 C    4.737700      -1.643000     -0.5227000    
 C   -8.160700       1.992000     -0.3400000    
 C    8.150600       1.992500      0.3401000    
 C   -8.833800      0.7865000     -0.5149000    
 C    8.823800      0.7868000      0.5128000    
 C   -1.886200     -0.4352000     -6.8000004E-02
 C    1.911400     -0.4348000      7.4400000E-02
 C  -0.4948000     -0.4352000      0.4392000    
 C   0.5199000     -0.4340000     -0.4327000    
 H   -4.211200       1.703900      0.6654000    
 H    4.195700       1.701100     -0.6664000    
 H   -6.605600      -2.600500      4.1400000E-02
 H    6.595700      -2.599700     -4.8599999E-02
 H   -6.302600       2.947700      0.1355000    
 H    6.292200       2.948700     -0.1335000    
 H   -8.703600      -1.352300     -0.4886000    
 H    8.693800      -1.352000      0.4830000    
 H   -4.226500      -2.589200      0.6482000    
 H    4.211000      -2.582700     -0.6564000    
 H   -8.687800       2.932400     -0.4714000    
 H    8.677600       2.932900      0.4728000    
 H   -9.886400      0.7861000     -0.7827000    
 H    9.876400      0.7860000      0.7804000    
 H  -0.3431000     -0.4364000       1.513000    
 H   0.3648000     -0.4330000      -1.506200    


%chk=000052653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052653

0 1
O -2.963635 0.065413 0.272817
O 2.960852 0.064910 -0.272786
O -1.865030 0.099509 -1.826489
O 1.862341 0.029770 1.826604
C -6.644119 0.058948 0.635273
C 6.641252 0.067289 -0.636046
C -7.100918 0.082497 -0.741038
C 7.098347 0.043728 0.740190
C -5.239731 0.054685 0.899305
C 5.236829 0.072944 -0.899755
C -6.124509 0.100713 -1.789672
C 6.122197 0.026973 1.789054
C -4.325724 0.072833 -0.156471
C 4.323072 0.055987 0.156261
C -7.616611 0.040565 1.691277
C 7.613543 0.084501 -1.692270
C -8.509660 0.086675 -1.007171
C 8.507167 0.038150 1.005980
C -4.754275 0.096358 -1.524080
C 4.751904 0.032663 1.523768
C -8.981992 0.045136 1.399911
C 8.978975 0.078688 -1.401221
C -9.433267 0.068368 0.040335
C 9.430544 0.055259 -0.041733
C -1.836122 0.077903 -0.573870
C 1.833425 0.051622 0.573988
C -0.623978 0.061436 0.277547
C 0.621236 0.068424 -0.277360
H -4.867341 0.036901 1.928600
H 4.864168 0.090709 -1.928952
H -6.466709 0.118600 -2.830981
H 6.464589 0.009212 2.830299
H -7.271487 0.022814 2.731763
H 7.268188 0.102455 -2.732676
H -8.852694 0.104509 -2.048482
H 8.850403 0.020194 2.047223
H -4.020315 0.110213 -2.329592
H 4.018050 0.019913 2.329398
H -9.717076 0.030950 2.211966
H 9.713895 0.092054 -2.213437
H -10.507901 0.071663 -0.171808
H 10.505227 0.050852 0.170143
H -0.758404 0.043285 1.363780
H 0.755695 0.086630 -1.363591


