%chk=000094362.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094362

0 1
 O   -1.727400     -0.2784000     -1.7600000E-02
 O    1.850100      0.3544000      2.7100001E-02
 O    5.403700     -0.3993000      1.7000001E-02
 O    8.980400      0.2335000     -4.2100001E-02
 C   -5.410000      0.4662000     -8.8000000E-03
 C   -6.678600     -0.3913000     -2.1600001E-02
 C   -4.121600     -0.3546000     -2.8600000E-02
 C   -7.968100      0.4306000     -2.6699999E-02
 C   -2.889200      0.5389000      1.8300001E-02
 C   -9.196400     -0.4649000      3.3900000E-02
 C  -0.5394000      0.5007000      2.3600001E-02
 C   0.6610000     -0.4259000      6.5000001E-03
 C    3.010700     -0.4648000      1.2300000E-02
 C    4.241700      0.4210000      1.1200000E-02
 C    6.591300      0.3803000     -5.9000002E-03
 C    7.791800     -0.5464000      1.4000000E-03
 H   -5.420200       1.103200      0.8844000    
 H   -5.423400       1.137700     -0.8762000    
 H   -6.670800      -1.048400      0.8570000    
 H   -6.663300      -1.043400     -0.9037000    
 H   -4.086100     -0.9811000     -0.9285000    
 H   -4.100900      -1.047900      0.8214000    
 H   -8.011100       1.047700     -0.9315000    
 H   -7.977500       1.111500      0.8322000    
 H   -2.891300       1.133600      0.9393000    
 H   -2.885100       1.218800     -0.8418000    
 H  -0.5015000       1.177100     -0.8390000    
 H  -0.5204000       1.117000      0.9307000    
 H   -10.10760      0.1415000      2.6699999E-02
 H   -9.197400      -1.068800      0.9470000    
 H   -9.231300      -1.141100     -0.8262000    
 H   0.6357000      -1.052100     -0.8936000    
 H   0.6305000      -1.092500      0.8768000    
 H    3.022100      -1.119200      0.8924000    
 H    3.012600      -1.105200     -0.8782000    
 H    4.235100       1.071500      0.8943000    
 H    4.236100       1.064900     -0.8767000    
 H    6.626500       1.043400      0.8670000    
 H    6.612800       1.010800     -0.9032000    
 H    7.798900      -1.164500      0.9053000    
 H    7.769500      -1.216700     -0.8643000    
 H    9.728500     -0.3877000     -3.6200002E-02


%chk=000094362-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000094362

0 1
O -1.736226 -0.207730 -0.006666
O 1.891229 0.352622 0.001393
O 5.479863 -0.408409 0.002076
O 9.099295 0.186675 -0.002254
C -5.491244 0.508855 0.005943
C -6.733750 -0.409988 0.002576
C -4.161194 -0.279341 -0.002185
C -8.068657 0.369475 0.006608
C -2.936410 0.639110 0.006862
C -9.305259 -0.555063 0.003732
C -0.498651 0.577033 0.005212
C 0.650495 -0.429411 -0.004225
C 3.083879 -0.499549 -0.004742
C 4.286385 0.442487 -0.003258
C 6.718498 0.376254 -0.002114
C 7.871018 -0.625720 0.006719
H -5.528002 1.167803 0.898892
H -5.531964 1.179483 -0.878073
H -6.698311 -1.079180 0.887489
H -6.699133 -1.071600 -0.888102
H -4.110909 -0.928434 -0.897775
H -4.110870 -0.946633 0.879910
H -8.102206 1.038241 -0.877943
H -8.101017 1.031018 0.896602
H -2.933461 1.284165 0.915578
H -2.937708 1.307209 -0.885037
H -0.437598 1.235377 -0.888176
H -0.442132 1.214652 0.913801
H -10.246389 0.024999 0.004222
H -9.311313 -1.210833 0.894940
H -9.309814 -1.206842 -0.890443
H 0.591345 -1.068409 -0.910988
H 0.593424 -1.084248 0.891280
H 3.107675 -1.152117 0.894058
H 3.102884 -1.145503 -0.908384
H 4.261006 1.093123 0.896883
H 4.267236 1.090293 -0.905566
H 6.774193 1.030205 0.894169
H 6.776946 1.016411 -0.908138
H 7.805627 -1.259318 0.914780
H 7.803667 -1.276445 -0.889036
H 9.887950 -0.410618 0.004781


