%chk=000067280.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067280

0 1
 O    10.67710      -1.075800      0.3768000    
 O   -10.67680      -1.075700     -0.3753000    
 O    10.78250      0.8843000     -0.7692000    
 O   -10.78190      0.8843000      0.7709000    
 N   0.2602000      1.4100000E-02  0.5693000    
 N  -0.2599000      1.4100000E-02 -0.5712000    
 C    4.435400      1.3700000E-02  0.2403000    
 C   -4.435000      1.3800000E-02 -0.2408000    
 C    5.877800      1.3900000E-02  0.1261000    
 C   -5.877300      1.3800000E-02 -0.1262000    
 C    3.740500       1.221800      0.2948000    
 C   -3.740000       1.221800     -0.2956000    
 C    3.740100      -1.194300      0.2952000    
 C   -3.739600      -1.194200     -0.2960000    
 C    6.525300       1.059800     -0.5312000    
 C   -6.524700       1.059800      0.5315000    
 C    6.620700      -1.032400      0.6731000    
 C   -6.620600      -1.032400     -0.6729000    
 C    1.654400      1.4000000E-02  0.4593000    
 C   -1.660800      1.3900000E-02 -0.4603000    
 C    2.349900       1.221800      0.4044000    
 C   -2.349500       1.221800     -0.4056000    
 C    2.349500      -1.194100      0.4046000    
 C   -2.349200      -1.194100     -0.4059000    
 C    8.658800      1.3300000E-02 -9.4599999E-02
 C   -8.658300      1.3400000E-02  9.5600002E-02
 C    7.915900       1.059500     -0.6417000    
 C   -7.915300       1.059500      0.6424000    
 C    8.011200      -1.032600      0.5627000    
 C   -8.010900      -1.032500     -0.5621000    
 C    10.10840      1.2900000E-02 -0.2103000    
 C   -10.10800      1.2800000E-02  0.2117000    
 H    4.240700       2.186200      0.2866000    
 H   -4.240300       2.186300     -0.2871000    
 H    4.235500      -2.158800      0.2253000    
 H   -4.235000      -2.158700     -0.2259000    
 H    5.987200       1.879500     -0.9994000    
 H   -5.986400       1.879500      0.9995000    
 H    6.162400      -1.851800       1.220200    
 H   -6.162400      -1.851800      -1.220200    
 H    1.817200       2.168000      0.4539000    
 H   -1.815600       2.167200     -0.4553000    
 H    1.815500      -2.140200      0.4407000    
 H   -1.814100      -2.139300     -0.4422000    
 H    8.401500       1.879900      -1.163700    
 H   -8.400600       1.879900       1.164500    
 H    8.551600      -1.863000       1.008600    
 H   -8.551500      -1.862900      -1.008000    
 H    11.65460      -1.066200      0.2938000    
 H   -11.65430      -1.066300     -0.2920000    


%chk=000067280-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000067280

0 1
O 10.964487 -0.680146 -1.113543
O -10.963707 -0.701265 1.103628
O 11.187456 0.472563 0.890582
O -11.187650 0.484288 -0.881148
N 0.347807 0.020889 0.556600
N -0.347519 0.029703 -0.555900
C 4.617553 0.005096 0.244215
C -4.617364 0.008424 -0.243876
C 6.103028 -0.008724 0.175122
C -6.102828 -0.007017 -0.174923
C 3.941393 -0.007678 1.497287
C -3.941192 0.016112 -1.496977
C 3.827120 0.028517 -0.945425
C -3.826935 0.012831 0.945984
C 6.891207 0.591732 1.199892
C -6.891415 0.610146 -1.189397
C 6.780196 -0.624879 -0.916951
C -6.779583 -0.641512 0.906861
C 1.764115 0.020405 0.368576
C -1.763893 0.026251 -0.367945
C 2.537258 -0.000791 1.559752
C -2.537037 0.024178 -1.559298
C 2.426301 0.037590 -0.893390
C -2.426127 0.022969 0.894120
C 8.954246 -0.043391 0.044167
C -8.954016 -0.044704 -0.043918
C 8.294559 0.576184 1.137596
C -8.294758 0.593135 -1.127061
C 8.184491 -0.644900 -0.984837
C -8.183850 -0.663035 0.974748
C 10.438824 -0.036808 0.020644
C -10.438589 -0.038950 -0.019853
H 4.518967 -0.058669 2.426179
H -4.518715 -0.019896 -2.426606
H 4.326188 0.074631 -1.919623
H -4.325976 0.043115 1.920806
H 6.397881 1.102574 2.033399
H -6.398478 1.134982 -2.014384
H 6.200346 -1.121838 -1.701906
H -6.199425 -1.151380 1.683258
H 2.010052 -0.022539 2.518943
H -2.009859 0.018020 -2.518730
H 1.821144 0.066202 -1.804234
H -1.820979 0.036943 1.805309
H 8.900769 1.045299 1.919363
H -8.901282 1.074963 -1.900814
H 8.696885 -1.128233 -1.821059
H -8.695951 -1.160309 1.802933
H 11.957259 -0.641365 -1.068254
H -11.956506 -0.662212 1.059188


