%chk=000151736.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151736

0 1
 O    1.187200      -2.858100      -2.426400    
 O  -0.8647000       2.280900       1.230000    
 O   -3.557300       2.239900       1.006500    
 O   -4.783800      0.6530000     -0.8881000    
 O    5.125500       2.021100     -0.1532000    
 O    4.456700      0.2361000       1.870900    
 O  -5.1899999E-02  -4.514000       1.053000    
 N  -0.1699000      -2.195800      0.8842000    
 C   0.8010000      -2.027200     -0.1792000    
 C   0.1781000      -2.308600      -1.570900    
 C  -0.4500000      -1.132700      -2.328300    
 C    1.541200     -0.6971000      1.4400000E-02
 C   -1.272400     -0.2268000      -1.453700    
 C  -0.6382000      0.5880000     -0.4949000    
 C   0.8456000      0.5454000     -0.3563000    
 C   -1.415400       1.406200      0.3404000    
 C   -2.668200     -0.2008000      -1.568300    
 C    2.759300     -0.7527000      0.5859000    
 C    1.453300       1.700600     -0.6897000    
 C   -2.804200       1.424500      0.2137000    
 C   -3.429000      0.6238000     -0.7396000    
 C    3.706800      0.3415000      0.9023000    
 C  -0.5093000      -3.430000       1.405600    
 C    2.858200       2.006600     -0.7492000    
 C    3.856800       1.475400     -3.9099999E-02
 C   -1.520600      -3.317600       2.514800    
 C  -0.6047000       1.783600       2.537300    
 C   -4.345600       3.229500      0.3502000    
 C   -5.541800     -0.2644000     -0.1016000    
 C    5.857400       1.369500      -1.170500    
 H    1.530700      -2.836900     -2.9500000E-02
 H  -0.5832000      -3.091800      -1.459100    
 H   -1.063100      -1.529200      -3.149100    
 H   0.3219000     -0.5433000      -2.842300    
 H  -0.6273000      -1.372100       1.264000    
 H   -3.166100     -0.8248000      -2.306800    
 H    3.138400      -1.720600      0.9130000    
 H   0.8465000       2.549500      -1.009600    
 H   0.7603000      -3.104900      -3.264700    
 H    3.090800       2.847600      -1.402100    
 H   -2.373600      -2.715600       2.187800    
 H   -1.056600      -2.849100       3.387000    
 H   -1.879100      -4.313400       2.789500    
 H   -1.533200       1.460700       3.019200    
 H   0.1069000      0.9529000       2.507600    
 H  -0.1686000       2.592000       3.130700    
 H   -3.932700       3.512100     -0.6246000    
 H   -5.375000       2.877100      0.2403000    
 H   -4.360900       4.121500      0.9837000    
 H   -5.275800      -1.295700     -0.3545000    
 H   -6.601500     -0.1115000     -0.3233000    
 H   -5.377900     -8.5100003E-02  0.9656000    
 H    6.854100       1.818800      -1.215100    
 H    5.979400      0.3023000     -0.9535000    
 H    5.385500       1.501600      -2.150600    


%chk=000151736-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000151736

0 1
O 1.156460 -3.070557 -2.530579
O -0.910981 2.057252 1.250493
O -3.725326 2.050073 1.018730
O -4.952769 0.424819 -1.049618
O 5.066314 2.145398 -0.473180
O 5.150939 -0.574859 0.397706
O 0.693818 -4.097981 1.736490
N -0.270496 -2.222750 0.737379
C 0.716168 -2.144820 -0.356372
C 0.073677 -2.460912 -1.740986
C -0.499387 -1.220261 -2.476706
C 1.515119 -0.823229 -0.336495
C -1.351610 -0.359232 -1.564122
C -0.711710 0.416760 -0.545789
C 0.787599 0.430934 -0.424894
C -1.532463 1.213086 0.312827
C -2.757219 -0.358392 -1.686712
C 2.893737 -0.989022 -0.194000
C 1.388227 1.701503 -0.448943
C -2.949380 1.221939 0.171383
C -3.562604 0.412748 -0.822178
C 4.036123 -0.089398 -0.031618
C -0.190491 -3.190471 1.732722
C 2.750173 2.100549 -0.458840
C 3.932243 1.357339 -0.360298
C -1.252154 -3.082868 2.825570
C -1.244932 1.823619 2.675675
C -4.212481 3.279319 0.342263
C -5.805685 0.031542 0.097729
C 6.406339 1.581119 -0.773224
H 1.406222 -2.985272 -0.165611
H -0.735801 -3.201161 -1.562407
H -1.089976 -1.556109 -3.349927
H 0.363978 -0.642446 -2.857410
H -0.992122 -1.502194 0.791462
H -3.252662 -0.954204 -2.459691
H 3.237006 -2.027734 -0.093918
H 0.688516 2.541487 -0.517730
H 0.812642 -3.318284 -3.425801
H 2.925290 3.177239 -0.582609
H -1.956942 -2.245784 2.676279
H -0.749092 -2.959984 3.800337
H -1.821318 -4.027295 2.869911
H -2.328295 1.942434 2.843460
H -0.907453 0.814681 2.982021
H -0.678925 2.587015 3.229950
H -3.355265 3.895034 0.014460
H -4.848151 3.014764 -0.522395
H -4.800082 3.820788 1.099097
H -5.614888 -1.025772 0.362792
H -6.839718 0.145580 -0.260616
H -5.620226 0.680766 0.970606
H 7.032118 2.473862 -0.924989
H 6.759513 0.955853 0.057730
H 6.368383 0.975388 -1.695614


