%chk=000115018.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115018

0 1
 O    1.421200      -2.208500       1.616900    
 O    2.335900      -1.843300      -1.889100    
 C   -1.142000      -1.028700      0.1105000    
 C   0.2358000     -0.8092000      0.1114000    
 C   -1.992100      3.9299998E-02  1.0100000E-02
 C   -1.914200      -2.316500      0.2013000    
 C    1.196300      -1.968600      0.2295000    
 C   -3.298700     -0.3747000      2.3200000E-02
 C   -3.397300      -1.864100      0.1536000    
 C   0.7332000      0.5261000      3.5100002E-02
 C    2.528900      -1.699700     -0.4817000    
 C   -1.585800       1.366400     -9.4400004E-02
 C    2.200800      0.7537000      7.0500001E-02
 C    3.080600     -0.3254000     -0.1739000    
 C  -0.1956000       1.596100     -8.2500003E-02
 C   -4.309200      0.5662000     -7.5599998E-02
 C   -2.611500       2.325300     -0.1976000    
 C   -3.960100       1.920900     -0.1875000    
 C    2.774700       2.006400      0.3581000    
 C    4.472300     -0.1327000     -0.1634000    
 C   -5.743300      0.1638000     -6.4400002E-02
 C    4.160900       2.187500      0.3777000    
 C    5.009200       1.120000      0.1122000    
 H   -1.686300      -2.972300     -0.6454000    
 H   -1.698700      -2.841200       1.137700    
 H   0.7497000      -2.873800     -0.1973000    
 H   -3.917700      -2.147500       1.074200    
 H   -3.909600      -2.306600     -0.7068000    
 H    3.253300      -2.461100     -0.1666000    
 H   0.1484000       2.623700     -0.1746000    
 H   -2.371500       3.382000     -0.2835000    
 H   -4.732000       2.683000     -0.2672000    
 H    2.158200       2.871800      0.5864000    
 H    5.142900     -0.9635000     -0.3680000    
 H    1.653100      -1.367900       2.047100    
 H   -5.987100     -0.3520000      0.8702000    
 H   -5.959300     -0.5005000     -0.9075000    
 H   -6.409800       1.029000     -0.1470000    
 H    3.090400      -1.434400      -2.346100    
 H    4.574600       3.166600      0.6021000    
 H    6.085600       1.262000      0.1237000    


%chk=000115018-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115018

0 1
O 1.558324 -2.308415 1.673190
O 2.213804 -1.824122 -1.941814
C -1.102824 -1.073546 0.118636
C 0.271503 -0.840819 0.125602
C -2.003630 0.023227 0.015505
C -1.913602 -2.364823 0.210035
C 1.259916 -1.983311 0.254105
C -3.365821 -0.382326 0.024243
C -3.422292 -1.903087 0.161098
C 0.751405 0.529896 0.022279
C 2.567598 -1.698178 -0.505662
C -1.571120 1.378107 -0.099857
C 2.223255 0.766170 0.057294
C 3.120627 -0.323431 -0.174304
C -0.157198 1.601167 -0.095206
C -4.375881 0.585131 -0.083958
C -2.611209 2.360134 -0.211699
C -3.956706 1.960655 -0.200869
C 2.784426 2.041463 0.342302
C 4.519049 -0.122876 -0.117074
C -5.848151 0.216776 -0.081605
C 4.180147 2.238500 0.377213
C 5.059598 1.154421 0.146557
H -1.677616 -3.047805 -0.627998
H -1.686468 -2.917026 1.140239
H 0.828295 -2.917446 -0.139590
H -3.964310 -2.206854 1.077595
H -3.960057 -2.368187 -0.687502
H 3.308476 -2.478188 -0.236385
H 0.212953 2.625550 -0.212779
H -2.356682 3.422483 -0.304774
H -4.738415 2.726246 -0.286016
H 2.126104 2.887614 0.564817
H 5.186007 -0.979601 -0.277556
H 1.795095 -1.465741 2.141408
H -6.131874 -0.309444 0.850257
H -6.095497 -0.462824 -0.919979
H -6.489797 1.109835 -0.172365
H 2.920541 -1.386114 -2.480383
H 4.582079 3.233304 0.599588
H 6.144146 1.301085 0.186812


