%chk=000052361.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052361

0 1
 O   -1.769200       3.546000       1.403300    
 O    1.373300      0.5666000     -0.3036000    
 O   8.1699997E-02   1.384300      -2.017600    
 N  -0.7366000       1.177300      0.1428000    
 C   -2.073900       1.680400     -9.3300000E-02
 C   -3.079900       1.031500      0.8705000    
 C   -2.087800       3.202400      5.9500001E-02
 C   -3.454200     -0.3775000      0.4755000    
 C   -2.709200      -1.439400      0.9625000    
 C   -4.535700     -0.5819000     -0.3660000    
 C   0.2230000       1.073600     -0.8395000    
 C   -3.055100      -2.740600      0.5980000    
 C   -4.881700      -1.883100     -0.7304000    
 C    2.466500      0.4018000      -1.213900    
 C   -4.141300      -2.962500     -0.2484000    
 C    3.642400     -0.1602000     -0.4704000    
 C    3.804900      -1.538000     -0.3794000    
 C    4.559400      0.7019000      0.1206000    
 C    4.898300      -2.060500      0.3114000    
 C    5.652900      0.1795000      0.8114000    
 C    5.822200      -1.201700      0.9068000    
 H   -2.345400       1.449000      -1.131100    
 H   -4.001900       1.628000      0.9035000    
 H   -2.697100       1.031200       1.900200    
 H   -3.076600       3.608400     -0.1779000    
 H   -1.349900       3.672200     -0.5996000    
 H  -0.4707000      0.9301000       1.091500    
 H   -1.862500      -1.278000       1.623200    
 H   -5.116800      0.2522000     -0.7488000    
 H   -2.478700      -3.581100      0.9735000    
 H   -5.727100      -2.055900      -1.390000    
 H    2.726800       1.370500      -1.658700    
 H    2.172700     -0.2748000      -2.026100    
 H   -1.791700       4.516300       1.462000    
 H   -4.410500      -3.975600     -0.5322000    
 H    3.090200      -2.216100     -0.8375000    
 H    4.436000       1.779300      5.4299999E-02
 H    5.029900      -3.136000      0.3863000    
 H    6.372000      0.8482000       1.275500    
 H    6.673400      -1.608600       1.445000    


%chk=000052361-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052361

0 1
O -2.544342 3.826415 1.605908
O 1.390967 1.917377 -0.215552
O -0.173723 1.170223 -1.827605
N -0.825854 2.122686 0.221262
C -2.277274 2.031364 0.022044
C -2.937289 0.977752 0.969981
C -2.895479 3.424657 0.228622
C -2.473895 -0.444943 0.706285
C -1.320793 -0.969525 1.344590
C -3.175275 -1.274168 -0.207289
C 0.086040 1.683239 -0.705594
C -0.875492 -2.282772 1.073413
C -2.737524 -2.589400 -0.479051
C 2.502058 1.423521 -1.091683
C -1.583544 -3.098476 0.161076
C 2.955398 0.036639 -0.685656
C 2.208637 -1.105041 -1.079082
C 4.128122 -0.139530 0.091117
C 2.627813 -2.397052 -0.694007
C 4.551716 -1.433150 0.472006
C 3.801008 -2.565671 0.079498
H -2.437371 1.722651 -1.027111
H -4.033188 1.050401 0.826511
H -2.727458 1.281385 2.011889
H -3.996756 3.374909 0.100726
H -2.467078 4.134023 -0.508251
H -0.489695 2.571227 1.075808
H -0.766878 -0.344584 2.055154
H -4.071948 -0.886820 -0.708309
H 0.023979 -2.665099 1.569114
H -3.294041 -3.215777 -1.185790
H 3.297790 2.171324 -0.945248
H 2.139389 1.443403 -2.134556
H -2.831828 4.757369 1.770796
H -1.243154 -4.119576 -0.046255
H 1.297277 -0.969576 -1.672625
H 4.709546 0.738468 0.399658
H 2.041991 -3.270959 -1.000959
H 5.461766 -1.557791 1.069775
H 4.128481 -3.569928 0.372293


