%chk=000038909.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038909

0 1
 O   -1.899600      -2.006300      -1.640800    
 O   0.9910000      -4.355100     -1.5300000E-02
 O    5.453300      -2.053100      0.2030000    
 O   -4.873800     -0.5106000       1.571700    
 O   -5.537400       1.648200       1.790900    
 C  -0.4079000      -1.096700      8.2999997E-02
 C   0.7961000      -1.951800     -0.3570000    
 C   -1.623300      -1.976800     -0.2446000    
 C   -1.201400      -3.375800      0.1965000    
 C   0.2891000      -3.351600     -5.3599998E-02
 C  -0.4317000      0.2732000     -0.5850000    
 C    2.052100      -1.657200      0.3859000    
 C   -1.590000       1.171000     -0.2491000    
 C    3.217100      -1.357400     -0.2069000    
 C    4.483200      -1.062100      0.5473000    
 C    5.080800      0.3077000      0.1975000    
 C   -2.466700       1.718700      -1.104300    
 C    4.107400       1.467600      0.4266000    
 C   -3.605600       2.598600     -0.6776000    
 C    4.672900       2.827500      4.3000001E-03
 C   -4.986400       2.048700      -1.060700    
 C    3.731400       3.996500      0.2967000    
 C   -5.309200      0.6883000     -0.4354000    
 C    4.334900       5.319400     -0.1507000    
 C   -5.276400      0.6893000       1.077500    
 H  -0.3791000     -0.9568000       1.174300    
 H   0.9358000      -1.891000      -1.443800    
 H   -2.526600      -1.643300      0.2750000    
 H   -1.364700      -3.521400       1.268300    
 H   -1.670200      -4.170000     -0.3892000    
 H   0.4809000      0.8140000     -0.3019000    
 H  -0.3726000      0.1541000      -1.674900    
 H    2.008400      -1.691700       1.472300    
 H   -1.708200       1.384200      0.8121000    
 H   -2.667100      -2.588200      -1.774700    
 H    3.270900      -1.328200      -1.292700    
 H    4.324000      -1.118300       1.630600    
 H    5.993000      0.4631000      0.7880000    
 H    5.409300      0.3063000     -0.8507000    
 H   -2.364000       1.523000      -2.168500    
 H    3.836900       1.501700       1.489200    
 H    3.179100       1.302700     -0.1321000    
 H   -3.564300       2.796200      0.3997000    
 H   -3.476200       3.572600      -1.165900    
 H    4.899100       2.802200      -1.069000    
 H    5.624700       2.994800      0.5238000    
 H   -5.057200       1.961300      -2.151900    
 H   -5.746200       2.777900     -0.7531000    
 H    5.097500      -2.918600      0.4685000    
 H    2.776800       3.841600     -0.2191000    
 H    3.517200       4.040800       1.370700    
 H   -4.603000     -6.3199997E-02 -0.8064000    
 H   -6.313200      0.3726000     -0.7402000    
 H    5.277000       5.517100      0.3707000    
 H    4.531500       5.316800      -1.227600    
 H    3.646900       6.142200      6.7100003E-02
 H   -4.830900     -0.5065000       2.551800    


%chk=000038909-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038909

0 1
O -1.917476 -1.941858 -1.603607
O 0.898126 -4.420432 0.252042
O 5.482019 -2.044428 0.138349
O -5.139307 -0.970055 1.207208
O -5.781926 1.207272 1.682564
C -0.510648 -1.051125 0.164943
C 0.699790 -1.968845 -0.195041
C -1.749665 -1.938291 -0.133356
C -1.331184 -3.333225 0.378145
C 0.190050 -3.393342 0.156012
C -0.495551 0.319054 -0.551279
C 2.007089 -1.607470 0.458574
C -1.646764 1.209224 -0.133039
C 3.160850 -1.334247 -0.203778
C 4.471528 -1.006756 0.474069
C 5.090249 0.324473 0.011404
C -2.545884 1.769564 -0.983500
C 4.273061 1.564850 0.433145
C -3.734248 2.610317 -0.565532
C 4.899525 2.888551 -0.059476
C -5.083450 2.022706 -1.072031
C 4.088998 4.137795 0.354990
C -5.304618 0.550151 -0.664145
C 4.712787 5.456189 -0.151916
C -5.436694 0.358447 0.833094
H -0.501786 -0.876236 1.263213
H 0.819817 -1.958051 -1.299192
H -2.669464 -1.559290 0.350998
H -1.518666 -3.423769 1.467837
H -1.842094 -4.181736 -0.110123
H 0.472515 0.809620 -0.314026
H -0.524627 0.154880 -1.643520
H 2.004104 -1.576052 1.560650
H -1.753185 1.396392 0.949435
H -2.660851 -2.551461 -1.839474
H 3.192380 -1.375202 -1.303463
H 4.317314 -0.980897 1.576569
H 6.112445 0.383220 0.433846
H 5.201749 0.295350 -1.090658
H -2.438051 1.577944 -2.063721
H 4.184457 1.592941 1.539815
H 3.238702 1.481921 0.039850
H -3.763068 2.705964 0.536161
H -3.639510 3.637735 -0.972961
H 4.989293 2.862026 -1.165735
H 5.934276 2.976534 0.333049
H -5.115573 2.077513 -2.177810
H -5.913457 2.643672 -0.687378
H 5.067755 -2.934995 0.278683
H 3.053500 4.044411 -0.032116
H 4.005485 4.167656 1.460793
H -4.482998 -0.090831 -1.029583
H -6.238281 0.162820 -1.120737
H 5.737077 5.588565 0.245263
H 4.779204 5.463545 -1.256413
H 4.114745 6.333540 0.156504
H -5.294464 -1.068047 2.186704


