%chk=000037437.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037437

0 1
 O    2.278500     -0.7420000      0.6143000    
 O    2.772200       1.384100       1.346000    
 N   -1.348000     -5.2999998E-03  0.6909000    
 C   -4.274200     -0.7948000      0.7429000    
 C   -5.850000     -2.0099999E-02 -0.6303000    
 C   -3.684200      0.5572000      0.2727000    
 C   -4.732300       1.045500     -0.7619000    
 C   -5.760000     -0.4378000      0.8397000    
 C   -4.294000      -1.840000     -0.3855000    
 C   -5.374400      -1.304400      -1.335700    
 C   -2.270900      0.4912000     -0.2870000    
 C   -5.231200       2.453700     -0.4510000    
 C   1.5799999E-02 -8.3600000E-02  0.1616000    
 C   0.9797000     -0.6539000       1.185900    
 C    3.075000      0.3516000      0.7682000    
 C    4.397000      0.1340000      0.1284000    
 C    5.078900       1.220400     -0.3802000    
 C    4.902700      -1.148100      6.2199999E-02
 C    6.320900       1.015800     -0.9814000    
 C    6.144600      -1.352800     -0.5390000    
 C    6.853700     -0.2708000      -1.060800    
 H   -3.836200      -1.165800       1.672500    
 H   -6.834000      0.3161000     -0.9644000    
 H   -3.679800       1.241000       1.134700    
 H   -4.324900       1.049200      -1.780400    
 H   -6.395400      -1.296200       1.083400    
 H   -5.967400      0.3756000       1.541900    
 H   -3.331100      -1.979400     -0.8820000    
 H   -4.601400      -2.816700      7.4000000E-03
 H   -6.193200      -2.028000      -1.421300    
 H   -4.982800      -1.114700      -2.340000    
 H   -2.245000     -0.1221000      -1.194600    
 H   -1.978700       1.503700     -0.5954000    
 H   -5.672700       2.523400      0.5483000    
 H   -5.993800       2.757700      -1.175600    
 H   -4.407300       3.172700     -0.5064000    
 H   -1.359100      0.5830000       1.523400    
 H   4.0199999E-02 -0.7161000     -0.7349000    
 H   0.3580000      0.9108000     -0.1509000    
 H   0.6796000      -1.671700       1.460600    
 H   0.9867000     -6.7800000E-02   2.113300    
 H    4.673000       2.226300     -0.3275000    
 H    4.377300      -2.005100      0.4726000    
 H    6.872800       1.858100      -1.388400    
 H    6.561300      -2.354100     -0.5982000    
 H    7.820900     -0.4302000      -1.528400    


%chk=000037437-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000037437

0 1
O 2.330811 -0.758876 0.490339
O 2.849084 1.335296 1.385306
N -1.324788 0.164780 0.513329
C -4.304227 -0.679341 0.907713
C -6.014729 -0.114744 -0.495924
C -3.761007 0.591201 0.175539
C -4.913039 0.940740 -0.849736
C -5.810527 -0.305155 1.036927
C -4.371849 -1.887921 -0.072061
C -5.556229 -1.502803 -1.036647
C -2.375315 0.478217 -0.482236
C -5.396049 2.402071 -0.747363
C 0.045408 0.068150 -0.026349
C 0.942426 -0.626258 1.012483
C 3.194383 0.315903 0.735444
C 4.546714 0.090993 0.146178
C 5.531057 1.095681 0.336492
C 4.863174 -1.080089 -0.590609
C 6.821879 0.930545 -0.205721
C 6.156414 -1.240501 -1.131408
C 7.136823 -0.237522 -0.940962
H -3.769295 -0.904196 1.844152
H -7.026157 0.181803 -0.823273
H -3.708178 1.408469 0.929470
H -4.555781 0.763883 -1.885678
H -6.428066 -1.119638 1.457546
H -5.984237 0.614226 1.625331
H -3.418234 -2.055083 -0.601674
H -4.596770 -2.815432 0.485755
H -6.377786 -2.240252 -0.973163
H -5.241931 -1.446777 -2.095375
H -2.378547 -0.329938 -1.240253
H -2.169061 1.428586 -1.038770
H -5.844846 2.607334 0.243135
H -6.158376 2.629101 -1.516327
H -4.556184 3.109649 -0.886060
H -1.372588 0.804901 1.319009
H 0.013406 -0.547707 -0.944450
H 0.494584 1.051374 -0.302341
H 0.604965 -1.657275 1.195297
H 0.968878 -0.054569 1.958214
H 5.262725 1.990318 0.908117
H 4.095943 -1.846674 -0.729205
H 7.580433 1.706705 -0.057624
H 6.401323 -2.144161 -1.700100
H 8.140168 -0.365417 -1.362762


