%chk=000001444.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001444

0 1
 O    1.118200       1.517800       2.049300    
 O   0.4434000      -1.181700       2.243600    
 O   0.4149000      -3.420800       1.877600    
 C    3.102200       1.280100     -0.9296000    
 C    3.022700      0.1437000      -1.943900    
 C    1.787800       1.584300     -0.2759000    
 C    3.975800      0.9131000      0.2365000    
 C    1.962200       1.375900       1.184700    
 C   -4.136700       1.969100     -0.2128000    
 C    3.356500      0.9605000       1.421100    
 C    2.416100      -1.146400      -1.468200    
 C   -3.826600      0.4809000     -2.5500000E-02
 C   0.6322000       1.974800     -0.8255000    
 C   -2.973100       2.888000      0.1734000    
 C   -5.029200     -0.3860000     -0.4006000    
 C   0.7745000      -3.039500      -1.396900    
 C    1.303000      -1.738500      -1.927000    
 C  -0.5636000       2.233900     -5.8400001E-02
 C   -1.720300       2.625400     -0.6137000    
 C  -0.6420000      -2.937900     -0.8143000    
 C  -0.7679000      -1.944300      0.3446000    
 C   -4.742600      -1.862600     -0.1789000    
 C   9.2500001E-02  -2.290000       1.540300    
 H    3.505800       2.182400      -1.404600    
 H    4.033100     -8.2400002E-02  -2.310600    
 H    2.466300      0.4969000      -2.822900    
 H    5.017700      0.6428000      0.1253000    
 H   -5.010000       2.239500      0.3936000    
 H   -4.411400       2.153000      -1.259400    
 H    3.775400      0.7435000       2.388800    
 H   -3.546700      0.2947000       1.018400    
 H   -2.973400      0.1891000     -0.6484000    
 H    2.964300      -1.650000     -0.6735000    
 H   0.5787000       2.109700      -1.902600    
 H   -3.273200       3.929100      3.5999999E-03
 H   -2.785300       2.792100       1.250100    
 H   -5.293700     -0.2229000      -1.451800    
 H   -5.898200     -9.6600004E-02  0.2017000    
 H   0.7563000      -3.758400      -2.225300    
 H    1.455000      -3.460400     -0.6475000    
 H   0.7417000      -1.266100      -2.728900    
 H  -0.5959000       2.114700       1.012000    
 H   -1.784800       2.771500      -1.689700    
 H  -0.9521000      -3.934500     -0.4769000    
 H   -1.340700      -2.641800      -1.606700    
 H  -0.5121000     -0.9375000     -9.9999997E-05
 H   -1.805000      -1.918700      0.6943000    
 H   -4.490500      -2.062100      0.8674000    
 H   -3.910500      -2.198200     -0.8054000    
 H   -5.621900      -2.461400     -0.4362000    
 H   0.9890000      -1.403400       3.028100    


%chk=000001444-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001444

0 1
O 1.327046 0.966300 2.332516
O -0.576936 -0.728914 1.528268
O 1.015533 -2.422501 1.596320
C 3.052568 1.315654 -0.912662
C 2.922042 0.191539 -2.006816
C 1.795074 1.500236 -0.062520
C 4.116465 0.999636 0.128299
C 2.126869 1.125449 1.341131
C -4.230102 2.168962 -0.144307
C 3.593069 0.903901 1.388879
C 2.581054 -1.170230 -1.438343
C -4.069753 0.658048 0.134336
C 0.601495 1.994409 -0.539957
C -3.036413 3.025189 0.377353
C -5.269614 -0.175921 -0.369060
C 1.354895 -3.378160 -1.286669
C 1.619041 -2.014554 -1.896397
C -0.601328 2.259555 0.227827
C -1.748609 2.740566 -0.350913
C -0.120355 -3.633076 -0.851049
C -0.799048 -2.468390 -0.098835
C -5.100265 -1.687704 -0.103282
C -0.012401 -1.915851 1.083692
H 3.314622 2.253804 -1.446185
H 3.892083 0.146554 -2.547020
H 2.160431 0.500733 -2.748365
H 5.164449 0.836232 -0.143942
H -5.160087 2.536507 0.334874
H -4.352712 2.335960 -1.235030
H 4.118100 0.654258 2.312959
H -3.940034 0.496586 1.224152
H -3.136001 0.288322 -0.334597
H 3.180739 -1.496006 -0.574680
H 0.547205 2.237809 -1.614289
H -3.297139 4.097091 0.246272
H -2.903507 2.851292 1.462089
H -5.405459 -0.003309 -1.456878
H -6.198039 0.184400 0.120232
H 1.628839 -4.171088 -2.014188
H 2.007936 -3.500487 -0.405519
H 0.992053 -1.711448 -2.752314
H -0.575381 2.056953 1.303602
H -1.759163 2.917098 -1.440618
H -0.131988 -4.543029 -0.221717
H -0.739547 -3.855200 -1.743575
H -0.982152 -1.615204 -0.778602
H -1.797387 -2.777720 0.270217
H -4.982789 -1.887680 0.978346
H -4.199924 -2.078843 -0.614579
H -5.971977 -2.264691 -0.463425
H 0.064405 -0.178636 2.097666


