%chk=000106568.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106568

0 1
 O    2.083500       1.757400      0.2043000    
 O    3.971700       2.584500     -0.8201000    
 O   0.8496000      -1.218500      -1.163000    
 O    1.797700      0.2258000      -2.640100    
 O    7.050000      -2.908200       1.170900    
 O    7.400100     -0.7524000       1.800600    
 C   -4.593100       1.092300      0.6888000    
 C   -5.579800      0.1530000     -1.3200000E-02
 C   -3.214000       1.127600      2.5800001E-02
 C   -7.006400      0.1385000      0.5477000    
 C   -2.224300       2.057200      0.7354000    
 C   -7.927100     -0.8614000     -0.1564000    
 C  -0.8375000       2.074700      8.7700002E-02
 C   -9.326700     -0.9381000      0.4624000    
 C   0.1184000       2.996700      0.8521000    
 C   -10.24120      -1.955300     -0.2213000    
 C    1.500300       3.052400      0.2119000    
 C   -11.63800      -1.937100      0.3812000    
 C    3.327300       1.663300     -0.3432000    
 C    3.822100      0.2644000     -0.2915000    
 C    3.135600     -0.7712000     -0.9254000    
 C    4.998100     -4.6000001E-03  0.4089000    
 C    5.487800      -1.308900      0.4751000    
 C    3.625200      -2.075700     -0.8590000    
 C    4.801300      -2.344500     -0.1590000    
 C    1.905000     -0.5227000      -1.665200    
 C    6.714200      -1.589300       1.204500    
 H   -4.487400      0.7818000       1.735300    
 H   -5.011600       2.106100      0.6998000    
 H   -5.629500      0.4249000      -1.075400    
 H   -5.175100     -0.8664000      2.5100000E-02
 H   -3.322400       1.447700      -1.017800    
 H   -2.800100      0.1120000      4.1000000E-03
 H   -6.962200     -0.1044000       1.616500    
 H   -7.435100       1.145000      0.4696000    
 H   -2.632900       3.075300      0.7451000    
 H   -2.129500       1.743800       1.782600    
 H   -7.469000      -1.857600     -0.1219000    
 H   -8.012900     -0.5889000      -1.215400    
 H  -0.9225000       2.410000     -0.9528000    
 H  -0.4378000       1.054600      6.8400003E-02
 H   -9.236900      -1.192800       1.525800    
 H   -9.789100      5.5799998E-02  0.4140000    
 H  -0.2982000       4.009400      0.8990000    
 H   0.2145000       2.628800       1.881000    
 H   -9.815400      -2.960600     -0.1250000    
 H   -10.30910      -1.732000      -1.292300    
 H    1.420700       3.426400     -0.8158000    
 H    2.136700       3.734100      0.7879000    
 H   -12.10190     -0.9521000      0.2677000    
 H   -12.27570      -2.672500     -0.1191000    
 H   -11.60810      -2.182600       1.447600    
 H    5.526900      0.8080000      0.9020000    
 H    3.103300      -2.892600      -1.351200    
 H    5.147400      -3.374100     -0.1337000    
 H   2.4900001E-02  -1.043100      -1.664400    
 H    7.877800      -3.086700       1.666000    


%chk=000106568-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106568

0 1
O 2.115249 1.784691 0.212439
O 4.137767 2.687146 -0.529863
O 1.103047 -1.648460 -1.712803
O 1.720188 0.507678 -2.311323
O 7.285987 -2.894469 1.211110
O 7.627916 -0.651163 1.710826
C -4.646665 1.047254 0.669461
C -5.631711 0.105640 -0.059213
C -3.246194 1.092069 0.017926
C -7.033297 0.062570 0.590233
C -2.263325 2.040180 0.741072
C -8.020688 -0.871951 -0.144688
C -0.868385 2.087764 0.079825
C -9.423161 -0.914911 0.502931
C 0.109883 3.031647 0.813804
C -10.411278 -1.845319 -0.237198
C 1.482430 3.140927 0.151439
C -11.810309 -1.881847 0.415223
C 3.423093 1.700100 -0.240122
C 3.901611 0.273433 -0.240187
C 3.164080 -0.800533 -0.820357
C 5.132290 0.005761 0.393819
C 5.615314 -1.321162 0.497308
C 3.648296 -2.128110 -0.701814
C 4.862038 -2.393686 -0.041562
C 1.958087 -0.536851 -1.664350
C 6.916099 -1.541704 1.191209
H -4.548369 0.726932 1.727932
H -5.071581 2.072711 0.694060
H -5.729016 0.426325 -1.117848
H -5.208030 -0.920484 -0.083580
H -3.345728 1.407632 -1.041980
H -2.818463 0.067489 -0.000770
H -6.937656 -0.263676 1.647190
H -7.454633 1.089389 0.619930
H -2.695173 3.063054 0.766916
H -2.158448 1.720526 1.799159
H -7.599797 -1.899068 -0.174690
H -8.115819 -0.545096 -1.201640
H -0.969181 2.414484 -0.976057
H -0.434351 1.069548 0.052127
H -9.330877 -1.246194 1.558688
H -9.844190 0.111984 0.536269
H -0.320218 4.053813 0.853775
H 0.239163 2.699900 1.862713
H -9.989953 -2.871015 -0.269985
H -10.502224 -1.513630 -1.291894
H 1.413915 3.421520 -0.916084
H 2.148284 3.856335 0.666821
H -12.265898 -0.873590 0.431621
H -12.496720 -2.553900 -0.132248
H -11.750584 -2.238557 1.460977
H 5.720201 0.825223 0.819055
H 3.067693 -2.940328 -1.146307
H 5.239281 -3.415135 0.051031
H 0.342373 -1.441474 -2.320163
H 8.157237 -2.984217 1.682436


