%chk=000227056.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227056

0 1
 O    4.233100       1.612000     -0.6586000    
 O    5.589700     -0.6318000     -7.2200000E-02
 O   -6.629900      -1.720400       1.276500    
 O    5.874100      -2.673100      0.9718000    
 C    1.150000      0.6476000     -0.1621000    
 C   2.0900000E-02   1.474900      0.4884000    
 C   -1.337200       1.267600     -0.1901000    
 C   -1.726000     -0.2471000     -8.6400002E-02
 C    2.339300       1.126000      0.7000000    
 C   0.7944000     -0.8362000     -1.4000000E-03
 C   0.6090000       2.880200      0.5594000    
 C  -0.5822000      -1.161800     -0.6097000    
 C   -3.138100     -0.5421000     -0.7184000    
 C    2.095700       2.639400      0.8775000    
 C   -2.420600       2.156800      0.4386000    
 C    1.384000      0.9706000      -1.661200    
 C   -3.790200       1.899900     -0.1816000    
 C   -4.141700      0.4355000     -9.6799999E-02
 C    3.685800      0.8291000      0.1166000    
 C   -3.146000     -0.3671000      -2.253600    
 C   -3.543100      -1.986300     -0.4579000    
 C   -5.256400      5.0500002E-02  0.5447000    
 C    4.324000     -0.4786000      0.5343000    
 C   -4.650400      -2.374800      0.1818000    
 C   -5.597700      -1.376900      0.7104000    
 C    6.270300      -1.783800      0.2307000    
 C    7.589100      -1.809700     -0.4807000    
 H  -9.6100003E-02   1.141800       1.533600    
 H   -1.257600       1.553200      -1.244500    
 H   -1.811300     -0.4723000      0.9900000    
 H    2.295600      0.6675000       1.697700    
 H   0.7822000      -1.110100       1.061400    
 H    1.547900      -1.471600     -0.4792000    
 H   0.1313000       3.489000       1.333800    
 H   0.5001000       3.409900     -0.3934000    
 H  -0.5165000      -1.099500      -1.700600    
 H  -0.8009000      -2.209000     -0.3741000    
 H    2.718600       3.272600      0.2374000    
 H    2.313700       2.928900       1.912400    
 H   -2.166100       3.214500      0.3027000    
 H   -2.468500       1.978900       1.521000    
 H    2.165300      0.3255000      -2.079600    
 H   0.4921000      0.8113000      -2.272900    
 H    1.696400       2.007100      -1.823200    
 H   -3.797200       2.222900      -1.229000    
 H   -4.533000       2.520700      0.3341000    
 H   -2.524300      -1.118500      -2.754000    
 H   -4.160700     -0.4750000      -2.658400    
 H   -2.780000      0.6144000      -2.569200    
 H   -2.900000      -2.770300     -0.8509000    
 H   -5.940500      0.7693000      0.9834000    
 H    3.673900      -1.302400      0.2296000    
 H    4.439300     -0.4680000       1.623600    
 H   -4.885600      -3.424300      0.3159000    
 H    8.197600     -0.9594000     -0.1628000    
 H    7.427100      -1.784900      -1.561200    
 H    8.119800      -2.732200     -0.2284000    


%chk=000227056-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227056

0 1
O 4.405646 1.066784 -0.611440
O 5.384088 -1.440892 -0.012190
O -6.809967 -1.538064 1.373989
O 6.793451 -0.224879 1.397397
C 1.141711 0.425888 -0.163824
C 0.051558 1.358355 0.460840
C -1.326564 1.233861 -0.224718
C -1.802698 -0.254188 -0.111911
C 2.373191 0.849272 0.742365
C 0.665032 -1.036777 -0.003189
C 0.740182 2.742174 0.536885
C -0.732950 -1.247454 -0.647933
C -3.251468 -0.473696 -0.749903
C 2.232985 2.404100 0.868833
C -2.360981 2.196336 0.402595
C 1.440190 0.747075 -1.652409
C -3.772653 2.002589 -0.213506
C -4.195196 0.551526 -0.114407
C 3.728226 0.399406 0.209868
C -3.232135 -0.267788 -2.305801
C -3.712477 -1.900632 -0.510589
C -5.329653 0.184906 0.560035
C 4.236012 -0.946149 0.753113
C -4.848214 -2.245894 0.158997
C -5.745162 -1.220693 0.745394
C 6.639303 -0.921963 0.372839
C 7.699544 -1.337642 -0.616419
H -0.085750 1.007520 1.510833
H -1.215729 1.504533 -1.295900
H -1.926343 -0.460290 0.975251
H 2.212991 0.371520 1.732285
H 0.606038 -1.286598 1.077418
H 1.379478 -1.746317 -0.466614
H 0.286495 3.393627 1.303917
H 0.659602 3.272526 -0.430717
H -0.643724 -1.154951 -1.746855
H -1.051496 -2.285721 -0.442752
H 2.930009 2.895087 0.168374
H 2.508161 2.730861 1.886995
H -2.038389 3.244800 0.260326
H -2.414205 2.016048 1.496070
H 2.162944 0.021642 -2.068079
H 0.529852 0.698816 -2.273219
H 1.885174 1.748116 -1.778485
H -3.741656 2.325118 -1.274524
H -4.507783 2.648931 0.298690
H -2.630695 -1.051607 -2.798756
H -4.258921 -0.329223 -2.706290
H -2.810563 0.712532 -2.585423
H -3.092019 -2.688545 -0.958557
H -5.984166 0.941577 1.010747
H 3.458240 -1.724098 0.675136
H 4.514577 -0.808481 1.817885
H -5.151518 -3.291883 0.285075
H 7.653947 -0.661802 -1.489669
H 7.521937 -2.363294 -0.976796
H 8.695007 -1.255607 -0.156079


