%chk=000173848.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173848

0 1
 O    4.359800      -1.191100     -5.7300001E-02
 O  -0.7949000       2.527200     -0.9295000    
 O   -2.173600      -1.958300      1.8500000E-02
 O   -2.807500      0.5286000      0.5328000    
 O    5.989600      0.3323000      0.4409000    
 O   -2.602900       2.975400      0.4370000    
 O   -4.186600      -1.364300     -0.9470000    
 O   -1.148100     -0.3267000       1.893700    
 C   0.4624000      0.4009000      -1.018100    
 C   3.1900000E-02  -1.013100     -0.5335000    
 C  -0.6767000       1.229500     -0.3695000    
 C    1.858900      0.8754000     -0.5104000    
 C   -1.486700      -1.041400     -0.8149000    
 C   0.8350000      -2.196100      -1.104600    
 C    2.461000      3.9099999E-02  0.6365000    
 C   -1.957000      0.4101000     -0.5991000    
 C    2.945500      -1.350200      0.1933000    
 C    2.354600      -1.955200      -1.084500    
 C   0.4305000      0.5660000      -2.558200    
 C    3.725600      0.6173000       1.284200    
 C   0.5100000      -3.504100     -0.3707000    
 C    4.831600     -4.8000000E-02  0.5152000    
 C    3.859200       2.129600       1.301500    
 C   -1.807500       3.303300     -0.4330000    
 C   -3.531500      -2.022300     -0.1501000    
 C   -2.274000      0.1217000       1.725100    
 C   -1.810700       4.638700      -1.113000    
 C   -4.120400      -3.028300      0.7918000    
 C   -3.277800      0.3039000       2.822900    
 H   0.1892000      -1.109800      0.5365000    
 H  -0.4269000       1.399500      0.6820000    
 H    1.760100       1.920800     -0.1956000    
 H    2.579800      0.8978000      -1.338400    
 H   -1.645200      -1.333100      -1.861500    
 H   0.5484000      -2.346500      -2.153900    
 H    1.705500     -4.4599999E-02   1.425900    
 H   -2.514400      0.7635000      -1.474200    
 H    2.849100      -2.064700       1.019900    
 H    2.876500      -2.900200      -1.292100    
 H    2.638000      -1.329200      -1.939300    
 H  -0.5549000      0.3604000      -2.986500    
 H   0.6977000       1.589600      -2.846000    
 H    1.142300     -0.1008000      -3.052800    
 H    3.798100      0.2426000       2.314100    
 H  -0.5347000      -3.792700     -0.5166000    
 H    1.121200      -4.328600     -0.7539000    
 H   0.6959000      -3.419700      0.7050000    
 H    2.992200       2.595000       1.780700    
 H    4.750900       2.426300       1.865300    
 H    3.972800       2.543000      0.2937000    
 H   -1.971400       4.506900      -2.185900    
 H  -0.8642000       5.151700     -0.9252000    
 H   -2.624400       5.248800     -0.7108000    
 H   -3.837400      -2.787600       1.819600    
 H   -3.775100      -4.029700      0.5237000    
 H   -5.211200      -2.998500      0.7189000    
 H   -4.209400     -0.2063000       2.565600    
 H   -3.456100       1.369400       2.985700    
 H   -2.888900     -0.1358000       3.745800    


%chk=000173848-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173848

0 1
O 4.394445 -1.152596 -0.098440
O -0.906195 2.515013 -1.030084
O -2.180979 -2.114324 0.084865
O -2.967679 0.470128 0.631706
O 6.024481 0.424664 0.393754
O -1.521477 3.459633 1.020210
O -4.006879 -2.103469 -1.371973
O -1.358285 -0.103730 2.239068
C 0.391359 0.365800 -1.053509
C 0.005575 -1.082701 -0.544485
C -0.743992 1.191571 -0.375306
C 1.794980 0.874716 -0.573181
C -1.518361 -1.121179 -0.788046
C 0.832309 -2.254390 -1.133333
C 2.401726 0.077229 0.602952
C -2.027209 0.340171 -0.509996
C 2.916857 -1.336888 0.158818
C 2.354561 -1.929925 -1.142835
C 0.302228 0.497012 -2.598979
C 3.679913 0.712069 1.237670
C 0.558995 -3.584234 -0.385417
C 4.846132 0.044040 0.493587
C 3.805875 2.244911 1.271072
C -1.307571 3.582487 -0.205730
C -3.462101 -2.525926 -0.329058
C -2.511540 0.283085 1.945190
C -1.434440 4.849127 -1.020942
C -4.028473 -3.531852 0.646128
C -3.600737 0.657144 2.921518
H 0.123558 -1.090864 0.555483
H -0.506868 1.362891 0.687380
H 1.686564 1.936019 -0.280891
H 2.502152 0.872437 -1.424708
H -1.767437 -1.382338 -1.833309
H 0.533445 -2.398086 -2.193631
H 1.636035 -0.037262 1.390994
H -2.649772 0.693499 -1.346259
H 2.839237 -2.054742 0.997661
H 2.918285 -2.856408 -1.361263
H 2.594276 -1.226121 -1.959807
H -0.700484 0.257696 -2.996584
H 0.529973 1.533509 -2.900619
H 1.029453 -0.170132 -3.093381
H 3.750433 0.337864 2.282261
H -0.507846 -3.859074 -0.423201
H 1.147321 -4.406168 -0.833492
H 0.836536 -3.508250 0.682687
H 2.987109 2.697382 1.858345
H 4.767458 2.525501 1.734085
H 3.792356 2.676889 0.255942
H -2.226668 4.729635 -1.780719
H -0.493606 5.054945 -1.559323
H -1.681812 5.692731 -0.361085
H -4.021638 -3.118015 1.668906
H -3.401506 -4.441041 0.659141
H -5.054277 -3.796901 0.353034
H -4.594086 0.375823 2.537830
H -3.589150 1.755002 3.053194
H -3.409360 0.183391 3.895807


