%chk=000137439.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137439

0 1
 O   -3.649900      -1.416100      0.1576000    
 O   -3.094200     -0.3134000     -0.6171000    
 O   -4.581900      0.8926000      0.6781000    
 C    2.210500       1.152100     -0.3237000    
 C    1.055400       1.569700      0.5909000    
 C    3.420700      0.6053000      0.4399000    
 C  -0.1570000       2.105900     -0.1788000    
 C    4.566400      0.1653000     -0.4739000    
 C   -1.320400       2.502900      0.7333000    
 C    5.774800     -0.3038000      0.3395000    
 C   -2.541500       3.028800     -3.1500001E-02
 C    6.934500     -0.7081000     -0.5705000    
 C   -3.203900       2.012900     -0.9581000    
 C    8.125400      -1.206400      0.2328000    
 C   -2.691100      -2.460600      6.4999998E-02
 C   -3.728800      0.8204000     -0.1971000    
 C   -1.370600      -1.961500      0.6498000    
 C   -3.221800      -3.644900      0.8698000    
 C   -2.526500      -2.840900      -1.405800    
 H    2.523700       2.013800     -0.9258000    
 H    1.854500      0.3875000      -1.025400    
 H    1.407500       2.338500       1.289400    
 H   0.7459000      0.7085000       1.195800    
 H    3.103700     -0.2456000       1.055600    
 H    3.782400       1.377900       1.129800    
 H   0.1479000       2.973700     -0.7763000    
 H  -0.4821000       1.332400     -0.8832000    
 H    4.223000     -0.6432000      -1.130400    
 H    4.860700       1.002700      -1.118100    
 H   -1.609000       1.648500       1.356900    
 H  -0.9796000       3.287300       1.420500    
 H    6.101200      0.4985000       1.012400    
 H    5.484700      -1.154700      0.9680000    
 H   -3.278100       3.379300      0.7025000    
 H   -2.247100       3.905600     -0.6208000    
 H    6.610300      -1.497800      -1.258300    
 H    7.244200      0.1476000      -1.181700    
 H   -4.057600       2.471600      -1.470700    
 H   -2.516300       1.689600      -1.746500    
 H    8.494300     -0.4295000      0.9101000    
 H    8.943100      -1.489100     -0.4375000    
 H    7.856600      -2.083900      0.8297000    
 H  -0.9195000      -1.166500      4.6100002E-02
 H   -1.520000      -1.546900       1.653500    
 H  -0.6372000      -2.772400      0.7179000    
 H   -4.192800      -3.975100      0.4830000    
 H   -3.385600      -3.362500       1.916100    
 H   -2.531600      -4.494500      0.8442000    
 H   -3.497700      -3.068000      -1.860200    
 H   -2.083500      -2.034200      -2.000100    
 H   -1.881200      -3.719300      -1.516300    


%chk=000137439-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137439

0 1
O -3.946240 -1.655081 -0.458723
O -3.358235 -0.348551 -1.008015
O -4.353735 0.729714 0.853978
C 2.261099 1.168156 -0.325842
C 1.093872 1.590527 0.594077
C 3.504458 0.676087 0.449145
C -0.152729 2.077426 -0.179632
C 4.671076 0.250942 -0.470687
C -1.315990 2.482959 0.754498
C 5.914385 -0.242439 0.303526
C -2.571824 3.024730 0.028990
C 7.080297 -0.668434 -0.617618
C -3.234213 2.020462 -0.948787
C 8.318962 -1.158140 0.163628
C -2.808050 -2.554800 -0.036845
C -3.734590 0.774996 -0.220230
C -1.995267 -1.893306 1.091679
C -3.622720 -3.764669 0.472124
C -1.942276 -2.909200 -1.260351
H 2.547651 2.024419 -0.971859
H 1.915914 0.365241 -1.010947
H 1.437628 2.394511 1.278151
H 0.809522 0.734309 1.242229
H 3.217654 -0.179139 1.096561
H 3.851074 1.479278 1.132881
H 0.126291 2.941262 -0.819092
H -0.480861 1.272333 -0.868823
H 4.324177 -0.551831 -1.155012
H 4.958456 1.106442 -1.117471
H -1.602478 1.615701 1.384422
H -0.956962 3.262709 1.456454
H 6.263705 0.559812 0.987137
H 5.628693 -1.098150 0.950833
H -3.324534 3.324621 0.781901
H -2.303925 3.932079 -0.547840
H 6.731086 -1.470970 -1.299277
H 7.363490 0.186717 -1.264918
H -4.118709 2.492227 -1.420291
H -2.552107 1.727674 -1.764404
H 8.710260 -0.362542 0.825719
H 9.135024 -1.462367 -0.517524
H 8.067146 -2.028047 0.799498
H -1.418858 -1.031955 0.709413
H -2.667495 -1.539325 1.891473
H -1.279642 -2.618339 1.520365
H -4.279102 -4.156516 -0.323747
H -4.245783 -3.482193 1.337359
H -2.927768 -4.566149 0.780030
H -2.554536 -3.391659 -2.041692
H -1.486577 -1.999644 -1.687582
H -1.131813 -3.601886 -0.968459


