%chk=000178939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178939

0 1
 O    1.100900      -1.455800      9.6500002E-02
 O   -1.587200      -2.549600      0.2473000    
 O   -3.121400       2.002900      0.2634000    
 O   -3.660500     -0.6984000      0.3270000    
 C   0.2749000      0.6494000      0.1096000    
 C    1.696700      0.7250000      3.6100000E-02
 C  -3.5500001E-02 -0.7065000      0.1439000    
 C    2.150600     -0.5903000      3.0800000E-02
 C   -1.333400      -1.209800      0.2164000    
 C  -0.7810000       1.578500      0.1506000    
 C   -2.096900       1.102100      0.2233000    
 C   -2.365600     -0.2681000      0.2554000    
 C    2.647000       1.760700     -2.7000001E-02
 C    3.495000     -0.9532000     -3.3100002E-02
 C    4.006600       1.426600     -9.2100002E-02
 C    4.420400      9.2600003E-02 -9.5100001E-02
 C   -1.139900      -3.318100     -0.8668000    
 C   -3.670700       2.412000     -0.9864000    
 H  -0.5809000       2.646000      0.1268000    
 H    2.341500       2.802800     -2.5800001E-02
 H    3.808600      -1.990300     -3.4899998E-02
 H    4.749300       2.218800     -0.1411000    
 H    5.481800     -0.1374000     -0.1465000    
 H   -3.661100      -1.671400      0.3381000    
 H   -1.743900      -4.228700     -0.9146000    
 H  -9.4300002E-02  -3.608300     -0.7317000    
 H   -1.264900      -2.771800      -1.808000    
 H   -4.080000       1.553600      -1.528400    
 H   -2.910000       2.912000      -1.594400    
 H   -4.481000       3.119300     -0.7898000    


%chk=000178939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178939

0 1
O 1.139499 -1.515377 -0.102982
O -1.864650 -2.389265 -0.108083
O -2.951277 2.341523 0.152989
O -3.690915 -0.474787 -0.008653
C 0.357988 0.706616 -0.012428
C 1.820024 0.730901 0.006674
C -0.005862 -0.668836 -0.080476
C 2.250776 -0.626380 -0.049708
C -1.345852 -1.078937 -0.108518
C -0.644015 1.698612 0.031204
C -2.003115 1.314046 0.015324
C -2.349277 -0.070479 -0.043505
C 2.798562 1.750138 0.065723
C 3.592694 -1.021950 -0.049992
C 4.162582 1.380225 0.066858
C 4.555336 0.015070 0.009809
C -1.075370 -3.446606 -0.772438
C -4.116264 2.332705 -0.758130
H -0.410861 2.764914 0.087296
H 2.508754 2.805094 0.111948
H 3.879594 -2.076214 -0.092437
H 4.932929 2.157369 0.113471
H 5.620070 -0.241641 0.012989
H -3.697433 -1.471702 -0.031823
H -1.697288 -4.351504 -0.705652
H -0.114919 -3.596461 -0.253909
H -0.891980 -3.183299 -1.830467
H -4.733511 1.433514 -0.603893
H -3.781138 2.385496 -1.812371
H -4.679980 3.241815 -0.499318


