%chk=000227209.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227209

0 1
 O   -4.501300      0.6223000     -0.4804000    
 O   0.2470000       2.514400     -0.4862000    
 O    3.679300      3.2200001E-02   1.283700    
 O   0.5530000      -2.691200     -0.2305000    
 O   0.1824000       1.165100      -2.360100    
 O    3.824700       1.038300     -0.7907000    
 O   0.9009000      -3.152900      -2.467200    
 C   -4.058000      0.5953000      0.8869000    
 C   -2.553700      0.4108000      0.9370000    
 C   -1.828900       1.546700      0.2160000    
 C   -4.829200     -0.5271000       1.559600    
 C  -0.2996000       1.456100      0.3030000    
 C   0.2383000       1.562300       1.737000    
 C   -6.150000     -0.4605000      0.8349000    
 C    1.768600       1.426600       1.793700    
 C   -5.715200     -0.1374000     -0.5790000    
 C    2.252200      8.8399999E-02   1.218000    
 C    1.700600      -1.132600       1.966500    
 C    2.204800      -2.494600       1.490300    
 C    1.952300      -2.759600      1.2800000E-02
 C   0.4353000       2.226500      -1.806500    
 C    4.337500      0.5455000      0.2049000    
 C    1.009500       3.421500      -2.505200    
 C    5.816500      0.4201000      0.4125000    
 C   0.1622000      -2.909100      -1.522700    
 C   -1.329200      -2.807100      -1.628200    
 H   -4.337600       1.557500       1.334400    
 H   -2.274300     -0.5366000      0.4612000    
 H   -2.249700      0.3544000       1.986300    
 H   -2.150700       2.513400      0.6258000    
 H   -2.129200       1.565300     -0.8391000    
 H   -4.919500     -0.3925000       2.641100    
 H   -4.355900      -1.498700       1.372200    
 H  -2.1600001E-02  0.4804000     -0.1090000    
 H  -1.8100001E-02   2.549800       2.141800    
 H  -0.2190000      0.8257000       2.401500    
 H   -6.736200      -1.380700      0.9015000    
 H   -6.754100      0.3611000       1.237700    
 H    2.241900       2.257300       1.256300    
 H    2.104600       1.523400       2.833700    
 H   -6.466200      0.4371000      -1.128400    
 H   -5.491200      -1.049300      -1.142700    
 H    1.947300      3.8999999E-03  0.1714000    
 H   0.6063000      -1.140500       1.918200    
 H    1.964700      -1.043200       3.028500    
 H    3.277900      -2.586400       1.693800    
 H    1.699500      -3.266400       2.084300    
 H    2.483500      -2.039100     -0.6180000    
 H    2.311400      -3.765400     -0.2353000    
 H    1.976900       3.677500      -2.065600    
 H   0.3167000       4.263300      -2.430000    
 H    1.158800       3.186100      -3.562900    
 H    6.115800      0.9864000       1.298000    
 H    6.340500      0.8287000     -0.4563000    
 H    6.087500     -0.6334000      0.5186000    
 H   -1.627400      -1.756700      -1.601100    
 H   -1.656000      -3.249900      -2.573300    
 H   -1.803600      -3.361600     -0.8140000    


%chk=000227209-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227209

0 1
O -4.606465 0.490712 -0.459764
O 0.268991 2.236896 -0.467655
O 3.776082 0.051171 1.242234
O 0.624111 -2.443155 -0.464148
O 0.093166 0.722929 -2.233872
O 3.856396 1.305057 -0.726524
O 0.840892 -3.341991 -2.604344
C -4.303985 0.754250 0.983180
C -2.795301 0.585560 1.221644
C -1.953659 1.584003 0.393044
C -5.202256 -0.219317 1.784982
C -0.447152 1.277898 0.443736
C 0.200503 1.461807 1.828638
C -6.404885 -0.456669 0.837448
C 1.745011 1.325582 1.833822
C -5.718194 -0.488489 -0.543109
C 2.265718 0.026702 1.184616
C 1.833240 -1.259748 1.897000
C 2.357459 -2.569759 1.261761
C 2.074559 -2.715941 -0.236943
C 0.516684 1.811707 -1.777278
C 4.441187 0.745139 0.231626
C 1.389107 2.803254 -2.506805
C 5.936037 0.740293 0.470775
C 0.138105 -2.760896 -1.748469
C -1.277821 -2.269582 -1.921891
H -4.599661 1.806899 1.181233
H -2.516491 -0.453827 0.951925
H -2.596220 0.710625 2.305574
H -2.130264 2.618677 0.749577
H -2.293706 1.529962 -0.657102
H -5.500550 0.196709 2.762299
H -4.663285 -1.170020 1.962493
H -0.272833 0.256557 0.052118
H -0.064240 2.464883 2.216323
H -0.251605 0.723879 2.518557
H -6.953191 -1.387890 1.061690
H -7.113120 0.389866 0.895930
H 2.173518 2.181791 1.283453
H 2.111312 1.374697 2.877720
H -6.373309 -0.177560 -1.374801
H -5.307358 -1.496265 -0.762360
H 1.989041 0.004820 0.115582
H 0.728631 -1.286228 1.891389
H 2.155623 -1.212926 2.955589
H 3.453852 -2.637294 1.398373
H 1.908211 -3.424764 1.801806
H 2.648923 -1.995980 -0.849242
H 2.310178 -3.731356 -0.601776
H 2.439900 2.592610 -2.233491
H 1.154736 3.835706 -2.203139
H 1.269588 2.681017 -3.593623
H 6.203701 1.589710 1.125975
H 6.465562 0.862842 -0.486134
H 6.253498 -0.186664 0.972946
H -1.233062 -1.197724 -2.190717
H -1.769005 -2.824951 -2.734754
H -1.852904 -2.364312 -0.986416


