%chk=000226527.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226527

0 1
 O   0.1677000      -1.987700      0.1314000    
 O   -1.157300      -3.860700     -5.7500001E-02
 O   -1.364900       2.285400     -8.6900003E-02
 O   -3.565100       2.883000     -0.4045000    
 C    2.570900      -1.922800      0.4737000    
 C    2.881500      -1.200400     -0.8542000    
 C    2.459400     -0.9819000       1.694300    
 C    4.195000     -0.4120000     -0.8310000    
 C    1.321500      -2.800900      0.2956000    
 C    4.485100      0.3146000      -2.147100    
 C    2.153500      -1.671300       3.016900    
 C    5.774900       1.120200      -2.122000    
 C   -1.011300      -2.648400     -3.6699999E-02
 C   -2.133900      -1.690100     -0.1979000    
 C   -1.890400     -0.3172000     -0.1632000    
 C   0.5156000       3.756300      0.1858000    
 C   -3.432700      -2.163500     -0.3844000    
 C   -2.945500      0.5823000     -0.3149000    
 C   0.9407000       3.067500       1.479500    
 C  -0.9881000       3.665400     -3.1599998E-02
 C   -4.244300      0.1089000     -0.5013000    
 C   -4.487900      -1.264000     -0.5363000    
 C   -2.692100       2.014200     -0.2789000    
 C    2.447800       3.123000       1.671200    
 H    3.408800      -2.606800      0.6685000    
 H    2.929400      -1.936100      -1.667000    
 H    2.060400     -0.5141000      -1.097500    
 H    1.694300     -0.2201000       1.505500    
 H    3.406000     -0.4464000       1.825700    
 H    5.023600      -1.092600     -0.6007000    
 H    4.166700      0.3399000     -3.5300002E-02
 H    1.189100      -3.455600       1.164600    
 H    1.441600      -3.442600     -0.5864000    
 H    4.539900     -0.4176000      -2.961400    
 H    3.652500      0.9889000      -2.380900    
 H    2.868700      -2.475600       3.214800    
 H    1.143400      -2.091100       3.026300    
 H    2.216600     -0.9506000       3.838700    
 H    5.933200       1.615200      -3.085100    
 H    6.635200      0.4728000      -1.925200    
 H    5.739000       1.889900      -1.344500    
 H    1.028200       3.273900     -0.6557000    
 H   0.8201000       4.808800      0.2005000    
 H  -0.8788000      4.9300000E-02 -1.7999999E-02
 H   0.4507000       3.548300       2.334300    
 H   0.6275000       2.017800       1.477400    
 H   -3.643600      -3.229100     -0.4146000    
 H   -1.522000       4.157200      0.7898000    
 H   -1.254000       4.151700     -0.9768000    
 H   -5.080700      0.7925000     -0.6217000    
 H   -5.499200      -1.632700     -0.6815000    
 H    2.799800       4.158500       1.718400    
 H    2.729800       2.624800       2.604100    
 H    2.966400       2.620200      0.8486000    


%chk=000226527-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226527

0 1
O 0.166093 -2.101807 0.083591
O -1.219137 -3.963784 -0.142818
O -1.417099 2.384761 -0.126796
O -3.680153 2.938067 -0.233811
C 2.573253 -2.114263 0.491615
C 2.855051 -1.125417 -0.674461
C 2.429552 -1.392610 1.860464
C 4.174748 -0.330069 -0.550495
C 1.358884 -2.997952 0.167911
C 4.469282 0.530135 -1.801080
C 2.175297 -2.330890 3.060835
C 5.759318 1.367576 -1.667464
C -1.072070 -2.717451 -0.081535
C -2.178149 -1.715551 -0.172569
C -1.923091 -0.324504 -0.140943
C 0.451089 3.938473 -0.156159
C -3.509582 -2.190121 -0.297038
C -2.997393 0.591431 -0.229965
C 1.180504 3.298735 1.047585
C -1.073022 3.838511 -0.081936
C -4.328565 0.114037 -0.348969
C -4.579941 -1.274279 -0.383652
C -2.773630 2.068513 -0.198205
C 2.716046 3.402257 0.928791
H 3.435602 -2.815276 0.565089
H 2.877917 -1.698822 -1.625511
H 2.004561 -0.419391 -0.758744
H 1.606810 -0.653892 1.786279
H 3.355642 -0.817553 2.050013
H 5.018932 -1.032398 -0.382867
H 4.139182 0.334431 0.335963
H 1.163857 -3.764073 0.938444
H 1.471066 -3.507457 -0.807631
H 4.543936 -0.129518 -2.689663
H 3.606920 1.203359 -1.988681
H 2.947567 -3.121695 3.123855
H 1.188721 -2.824884 2.997774
H 2.197730 -1.765240 4.010288
H 5.949171 1.968006 -2.576182
H 6.639324 0.717439 -1.502173
H 5.692630 2.064223 -0.809803
H 0.797936 3.468245 -1.097250
H 0.714660 5.014291 -0.220817
H -0.899158 0.041703 -0.049256
H 0.843828 3.792385 1.982042
H 0.881067 2.236109 1.127582
H -3.680498 -3.271559 -0.323196
H -1.476802 4.257457 0.859086
H -1.573656 4.339984 -0.929915
H -5.143419 0.842934 -0.412930
H -5.606994 -1.641317 -0.477885
H 3.042320 4.457697 0.862727
H 3.217554 2.948374 1.803231
H 3.079007 2.881241 0.022133


