%chk=000135397.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135397

0 1
 O    6.877900      -1.410000      0.3668000    
 O    4.988400      -2.592700      0.8113000    
 C   -4.141500      -1.312200     -0.3926000    
 C   -5.655100      -1.348900     -4.5800000E-02
 C   -6.322500      6.0000003E-04 -0.2419000    
 C   -3.453000     -5.7799999E-02  0.1951000    
 C   -5.673000       1.039200      0.6600000    
 C   -4.158700      0.9889000      0.6926000    
 C   -3.977600      -1.319200      -1.930000    
 C   -3.542800      -2.623900      0.1719000    
 C   -1.999800     -6.1700001E-02  0.1559000    
 C   -3.570800       2.225700       1.331900    
 C   -1.288000       1.015600     -0.1607000    
 C   0.1320000      0.9688000     -0.1887000    
 C    1.332400      0.9337000     -0.2146000    
 C    2.762100      0.8903000     -0.2460000    
 C    3.431400     -0.2790000      0.1114000    
 C    3.482900       2.018400     -0.6346000    
 C    4.825300     -0.3206000      7.9700001E-02
 C    4.876800       1.976800     -0.6658000    
 C    5.548000      0.8074000     -0.3088000    
 C    5.525500      -1.539500      0.4528000    
 H   -5.792800      -1.656400       1.000400    
 H   -6.170500      -2.101600     -0.6559000    
 H   -7.391000     -7.1699999E-02 -7.6000001E-03
 H   -6.253900      0.3154000      -1.289400    
 H   -6.042300      0.9071000       1.685300    
 H   -6.002900       2.031600      0.3281000    
 H   -4.517900      -2.159200      -2.381400    
 H   -4.353900     -0.3964000      -2.384700    
 H   -2.925200      -1.418600      -2.220600    
 H   -3.510800      -2.608400       1.267500    
 H   -4.145200      -3.489500     -0.1296000    
 H   -2.528300      -2.810500     -0.1964000    
 H   -1.490100     -0.9788000      0.4342000    
 H   -3.507600       3.042900      0.6068000    
 H   -2.594600       2.058300       1.793800    
 H   -4.216000       2.563300       2.152400    
 H   -1.742300       1.945000     -0.4839000    
 H    2.862800      -1.156100      0.4139000    
 H    2.974100       2.937300     -0.9159000    
 H    5.439100       2.855500     -0.9684000    
 H    6.633700      0.8192000     -0.3474000    
 H    7.340500      -2.237300      0.6198000    


%chk=000135397-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000135397

0 1
O 7.013199 -1.553515 0.182877
O 5.033092 -2.716785 0.517426
C -4.190177 -1.330448 -0.349680
C -5.722131 -1.361268 -0.070728
C -6.405187 -0.015243 -0.363886
C -3.543404 -0.012032 0.172273
C -5.825851 1.049703 0.582230
C -4.303481 1.041565 0.649657
C -3.929879 -1.459085 -1.880468
C -3.573003 -2.572278 0.364568
C -2.071111 0.003887 0.132282
C -3.736866 2.275479 1.332064
C -1.245313 1.087158 -0.094069
C 0.173467 1.008651 -0.128408
C 1.416046 0.986337 -0.169163
C 2.843348 0.934588 -0.210974
C 3.536062 -0.284653 0.034129
C 3.609563 2.106660 -0.500620
C 4.948864 -0.328864 -0.009812
C 5.017409 2.054577 -0.542164
C 5.697907 0.842176 -0.298521
C 5.611615 -1.634493 0.255510
H -5.890417 -1.619203 0.995437
H -6.172152 -2.174710 -0.672605
H -7.500596 -0.093749 -0.229173
H -6.229925 0.281219 -1.416176
H -6.230365 0.902454 1.608124
H -6.157109 2.065137 0.280133
H -4.300590 -2.432685 -2.254283
H -4.436371 -0.655387 -2.445130
H -2.850056 -1.393497 -2.107098
H -3.586234 -2.449732 1.463227
H -4.167540 -3.471035 0.113394
H -2.534225 -2.775591 0.049250
H -1.568106 -0.965415 0.246298
H -3.673869 3.138346 0.637779
H -2.731384 2.108511 1.751598
H -4.412105 2.587280 2.152656
H -1.681990 2.072203 -0.301499
H 2.981665 -1.200971 0.259268
H 3.083900 3.048419 -0.690252
H 5.587070 2.962877 -0.765284
H 6.789279 0.788761 -0.327825
H 7.391750 -2.454346 0.368537


