%chk=000142636.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142636

0 1
 O   -2.333100      0.3429000     -0.3963000    
 O    1.786900     -0.5111000     -0.1996000    
 O  -0.1099000      -2.489000      0.2147000    
 C   -3.666500      0.6522000     -1.7600000E-02
 C  -0.4984000      -1.223200     -0.3242000    
 C   -1.931900     -0.9288000      0.1028000    
 C   0.4675000     -0.1709000      0.2046000    
 C   -4.596700     -0.4110000     -0.6000000    
 C   -3.999700       2.028600     -0.5893000    
 C   -3.747000      0.6699000       1.508100    
 C    4.120400      2.5800001E-02 -0.2158000    
 C    2.734000      0.4485000      0.2489000    
 C    5.193400       1.007400      0.2465000    
 C    6.581100      0.5588000     -0.1828000    
 H  -0.4241000      -1.283000      -1.416100    
 H   -1.962900     -0.9795000       1.195500    
 H   -2.548100      -1.742200     -0.2921000    
 H   0.2108000      0.8205000     -0.1854000    
 H   0.4338000     -0.1453000       1.300700    
 H   -4.565000      -1.359300     -5.2999999E-02
 H   -5.639700     -7.5599998E-02 -0.5580000    
 H   -4.352100     -0.6239000      -1.647000    
 H   -3.895900       2.031700      -1.680400    
 H   -3.303600       2.785600     -0.2100000    
 H   -5.019200       2.338800     -0.3377000    
 H   -2.900600       1.211400       1.946000    
 H   -4.669600       1.160900       1.839500    
 H   -3.766300     -0.3312000       1.951800    
 H    4.337500     -0.9805000      0.1641000    
 H    4.128400     -5.9099998E-02  -1.309800    
 H    2.484100       1.432900     -0.1642000    
 H    2.706100      0.5069000       1.343300    
 H    4.991200       2.002100     -0.1673000    
 H    5.169200       1.099200       1.338600    
 H   0.8096000      -2.650900     -5.7700001E-02
 H    6.827100     -0.4189000      0.2439000    
 H    6.649700      0.4854000      -1.272900    
 H    7.333700       1.276900      0.1574000    


%chk=000142636-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000142636

0 1
O -2.404403 0.275675 -0.270618
O 1.809422 -0.369035 -0.230108
O 0.044303 -2.426940 0.160629
C -3.837518 0.585375 0.029740
C -0.453648 -1.127033 -0.312365
C -1.893198 -1.016080 0.199751
C 0.450350 -0.001201 0.205145
C -4.769985 -0.426480 -0.677136
C -4.008303 1.994667 -0.568250
C -4.080904 0.601684 1.557040
C 4.203359 0.038311 -0.222769
C 2.843371 0.553337 0.257308
C 5.371329 0.948126 0.224514
C 6.743240 0.423326 -0.251301
H -0.449540 -1.094881 -1.421956
H -1.894022 -1.079676 1.307652
H -2.480556 -1.864599 -0.203931
H 0.144382 0.974545 -0.220471
H 0.411858 0.049665 1.316032
H -4.695855 -1.436808 -0.236267
H -5.822259 -0.100471 -0.587011
H -4.516250 -0.491580 -1.750000
H -3.788009 1.977274 -1.649734
H -3.309519 2.700072 -0.085731
H -5.040514 2.359286 -0.421020
H -3.360736 1.277386 2.052113
H -5.102612 0.962753 1.775067
H -3.980555 -0.405325 2.000312
H 4.356180 -0.987376 0.166096
H 4.185842 -0.036677 -1.327241
H 2.647002 1.575002 -0.138333
H 2.809132 0.603566 1.369541
H 5.211806 1.973363 -0.167348
H 5.372102 1.032436 1.330577
H 1.031601 -2.394588 0.045466
H 6.941718 -0.587360 0.152084
H 6.780904 0.356998 -1.354815
H 7.564684 1.086262 0.076537


