%chk=000056003.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056003

0 1
 O   -2.678600       3.677800      0.6821000    
 O    3.356800      0.6126000      -1.787900    
 O    8.314700     -0.1893000      -1.620900    
 O    8.608600      -1.901500      0.5490000    
 N   -5.863700     -0.2075000     -2.5100000E-02
 N   -3.597200       1.560500      0.3250000    
 N    2.736400      0.4664000      0.4753000    
 C   -4.632300     -0.6853000      0.6095000    
 C   -5.925500       1.194800     -0.4468000    
 C   -3.425900      0.1182000      0.1234000    
 C   -4.971600       2.049200      0.3846000    
 C   -6.952600      -1.056400     -0.2077000    
 C   -2.548400       2.466200      0.5120000    
 C   -1.171700       1.946100      0.5020000    
 C   -7.847100     -0.8849000      -1.290300    
 C   -7.210400      -2.125400      0.6827000    
 C   -8.938200      -1.734600      -1.472400    
 C   -8.301400      -2.975200      0.5005000    
 C  -0.5843000       1.522500       1.690700    
 C  -0.4658000       1.880000     -0.6958000    
 C   -9.165300      -2.779800     -0.5770000    
 C   0.7201000       1.028700       1.681500    
 C   0.8386000       1.385900     -0.7049000    
 C    1.431600      0.9603000      0.4838000    
 C    3.597900      0.3242000     -0.6207000    
 C    4.928100     -0.2640000     -0.3134000    
 C    5.999600      5.5700000E-02  -1.120400    
 C    5.046900      -1.110500      0.7689000    
 C    7.247600     -0.4964000     -0.8318000    
 C    7.395200      -1.355500      0.2571000    
 C    6.294800      -1.662600       1.057500    
 C    9.089000      0.9495000      -1.249500    
 C    8.673900      -2.769400       1.678900    
 H   -4.728100     -0.5942000       1.698400    
 H   -4.453200      -1.740700      0.3712000    
 H   -5.660800       1.264700      -1.508800    
 H   -6.938400       1.596100     -0.3207000    
 H   -2.524800     -0.2388000      0.6284000    
 H   -3.280800     -3.0800000E-02 -0.9536000    
 H   -5.010100       3.091700      5.0700001E-02
 H   -5.267400       2.034600       1.441000    
 H   -7.693400     -8.8200003E-02  -2.014800    
 H   -6.565400      -2.299300       1.541100    
 H   -9.609600      -1.584500      -2.312800    
 H   -8.480300      -3.787400       1.199100    
 H   -1.131100       1.571200       2.628600    
 H  -0.9209000       2.208800      -1.626300    
 H   -10.01490      -3.441400     -0.7188000    
 H    1.169100      0.7001000       2.615500    
 H    1.322600       1.364500      -1.670900    
 H    3.088200      0.2267000       1.397700    
 H    5.895700      0.7278000      -1.967600    
 H    4.210400      -1.408900       1.391900    
 H    6.333500      -2.328600       1.912600    
 H    9.905300       1.058300      -1.968800    
 H    8.475400       1.855500      -1.276600    
 H    9.517700      0.8154000     -0.2513000    
 H    8.057300      -3.663400       1.537200    
 H    9.711300      -3.109400       1.764300    
 H    8.435400      -2.240900       2.608200    


%chk=000056003-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056003

0 1
O -2.987635 2.999638 1.895260
O 3.132618 -0.096472 -1.531536
O 8.113528 -0.704142 -2.051256
O 9.110561 -1.324273 0.539093
N -6.141289 -0.188134 -0.218196
N -3.744406 1.335140 0.474932
N 2.838350 0.509642 0.718528
C -4.923475 -0.848706 0.283446
C -6.076887 1.274378 -0.401306
C -3.671585 -0.030476 -0.094787
C -5.105300 1.915952 0.603191
C -7.302557 -0.920214 -0.512254
C -2.719537 1.994570 1.153067
C -1.300462 1.527347 0.982137
C -8.374961 -0.338913 -1.259611
C -7.451341 -2.274111 -0.074313
C -9.538797 -1.080891 -1.544651
C -8.618371 -3.004372 -0.376535
C -0.422841 1.676563 2.088272
C -0.761322 1.062532 -0.245069
C -9.676203 -2.419930 -1.110831
C 0.932144 1.328499 1.981056
C 0.600712 0.727495 -0.376195
C 1.460336 0.844004 0.750086
C 3.599458 0.031695 -0.357974
C 5.028080 -0.302100 -0.030063
C 5.950888 -0.326955 -1.105415
C 5.489267 -0.619583 1.272370
C 7.307149 -0.639382 -0.907070
C 7.762417 -0.967338 0.412747
C 6.843243 -0.949391 1.489253
C 9.406189 0.014322 -2.043369
C 9.585002 -1.754368 1.859326
H -4.952862 -0.999172 1.385483
H -4.827755 -1.847202 -0.184678
H -5.786352 1.548759 -1.439664
H -7.076631 1.708478 -0.216502
H -2.774273 -0.541050 0.290703
H -3.593221 0.005419 -1.200321
H -5.040199 3.004664 0.434055
H -5.479308 1.778276 1.637355
H -8.290834 0.681892 -1.645080
H -6.670516 -2.749412 0.527562
H -10.341263 -0.608418 -2.123526
H -8.704519 -4.038551 -0.022440
H -0.823889 2.085177 3.021116
H -1.399792 0.994631 -1.132484
H -10.581489 -2.991664 -1.338984
H 1.591768 1.439560 2.851639
H 1.013130 0.392034 -1.328792
H 3.347072 0.679011 1.588813
H 5.602337 -0.107498 -2.118698
H 4.801073 -0.672415 2.124486
H 7.171853 -1.218795 2.497115
H 9.807247 -0.125150 -3.058422
H 9.244487 1.092131 -1.849049
H 10.091539 -0.408219 -1.291510
H 9.031089 -2.646111 2.208930
H 10.644345 -2.009151 1.711560
H 9.496487 -0.940052 2.603802


