%chk=000075304.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075304

0 1
 O    2.624900      -2.244000       1.048800    
 O    5.384900       2.906200       1.217500    
 O   -4.278100       4.023000     -4.4900000E-02
 C    1.883200     -0.7513000      -1.270900    
 C   -2.875000      -1.440300      7.2600000E-02
 C   0.8851000      -1.320800     -0.3178000    
 C   -1.348200      -1.659300      0.3388000    
 C  -0.4753000      -1.124700     -0.5557000    
 C    2.854300      0.2627000     -0.5807000    
 C   -3.245700      3.7000000E-03  4.1400000E-02
 C    2.658400      -1.936400      -1.945500    
 C    1.281600      4.1299999E-02  -2.491400    
 C   -3.166800      -2.247100      -1.248600    
 C   -3.763300      -2.160100       1.147400    
 C    1.300500      -2.041300      0.8022000    
 C   -1.005100      -2.369400       1.446000    
 C   0.3552000      -2.565400       1.684200    
 C    2.300800       1.361000     -1.2000001E-03
 C    4.182500     -2.6600000E-02 -0.6099000    
 C   -3.026700      0.8042000       1.162300    
 C   -3.811500      0.5538000      -1.108900    
 C    3.166700       2.265200      0.6140000    
 C    5.048500      0.8775000      5.2999998E-03
 C   -3.373800       2.154900       1.133200    
 C   -4.158400       1.904500      -1.138200    
 C    4.540500       2.023500      0.6174000    
 C   -3.939500       2.705200     -1.7200001E-02
 H  -0.8399000     -0.5672000      -1.407800    
 H    3.237200      -2.553000      -1.251200    
 H    1.948100      -2.617400      -2.433700    
 H    3.339000      -1.586700      -2.732200    
 H    2.078900      0.4386000      -3.133000    
 H   0.6585000     -0.6070000      -3.120000    
 H   0.6685000      0.8963000      -2.184100    
 H   -4.239100      -2.255800      -1.480100    
 H   -2.643500      -1.839600      -2.121200    
 H   -2.851100      -3.293700      -1.148500    
 H   -4.826900      -2.011300      0.9173000    
 H   -3.598500      -3.244400       1.167200    
 H   -3.613700      -1.766800       2.159800    
 H   -1.688000      -2.796100       2.166700    
 H   0.6657000      -3.127900       2.560900    
 H    1.234600       1.557600      8.8999998E-03
 H    4.635000     -0.8961000      -1.065300    
 H   -2.583700      0.3999000       2.068300    
 H   -4.003600     -2.3499999E-02  -2.006400    
 H    2.758200       3.153500       1.088400    
 H    6.117900      0.6843000      5.5000000E-03
 H   -3.197100       2.768300       2.012700    
 H   -4.599000       2.327900      -2.036700    
 H    2.720200      -2.761600       1.866600    
 H    4.863400       3.638800       1.588100    
 H   -4.057300       4.423300      0.8137000    


%chk=000075304-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075304

0 1
O 2.722230 -2.364493 0.891628
O 5.444928 2.952055 1.455449
O -4.181631 4.097611 -0.468966
C 1.904948 -0.720855 -1.329994
C -2.969654 -1.554529 0.124798
C 0.889700 -1.361053 -0.350962
C -1.459261 -1.766815 0.402609
C -0.506153 -1.191383 -0.481929
C 2.867950 0.213438 -0.549849
C -3.263801 -0.045566 -0.075393
C 2.651942 -1.860387 -2.084662
C 1.196811 0.156605 -2.406699
C -3.340210 -2.398311 -1.131470
C -3.857988 -2.052109 1.303949
C 1.334380 -2.166570 0.740877
C -0.973290 -2.547790 1.473904
C 0.415675 -2.746081 1.640132
C 2.330374 1.176939 0.341388
C 4.272900 0.204835 -0.737829
C -2.806309 0.884717 0.895603
C -4.022802 0.461995 -1.160759
C 3.154834 2.096430 1.023267
C 5.114318 1.117529 -0.068133
C -3.091721 2.261273 0.795939
C -4.318213 1.837411 -1.279578
C 4.553948 2.066765 0.812900
C -3.854572 2.738308 -0.298144
H -0.882440 -0.566296 -1.297661
H 3.244453 -2.481049 -1.393916
H 1.915179 -2.508189 -2.592961
H 3.321500 -1.444894 -2.860314
H 1.962800 0.614713 -3.056941
H 0.525551 -0.448621 -3.044544
H 0.610089 0.976736 -1.955847
H -4.424906 -2.353705 -1.342586
H -2.792897 -2.058350 -2.028770
H -3.072902 -3.455348 -0.955606
H -4.918139 -1.834327 1.084160
H -3.759424 -3.143879 1.449941
H -3.600381 -1.545906 2.251505
H -1.660701 -3.008593 2.189309
H 0.783112 -3.358197 2.475415
H 1.248212 1.202651 0.517527
H 4.732213 -0.532142 -1.403097
H -2.202704 0.526135 1.737761
H -4.393827 -0.214796 -1.936307
H 2.711400 2.828973 1.711524
H 6.198954 1.105038 -0.213161
H -2.723038 2.957272 1.561563
H -4.901827 2.224339 -2.120418
H 2.914501 -2.846323 1.734035
H 4.950884 3.573024 2.046095
H -3.811497 4.642166 0.269317


