%chk=000003141.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003141

0 1
 O   -3.928900      -3.278300       1.047300    
 O    5.267200      -2.422600      -1.127700    
 O    6.909700      -1.342200      0.8373000    
 N  -0.1302000       1.737500     -0.4282000    
 C   -2.578400       2.059800     -0.1043000    
 C   -1.288800       1.364800      0.3783000    
 C   -3.805900       1.595400      0.7120000    
 C   -2.460600       3.586800     -2.7999999E-03
 C    1.061100       1.031600      1.9900000E-02
 C   -4.361100      0.2588000      0.2826000    
 C    2.278200       1.424000     -0.8185000    
 C    3.515300      0.6824000     -0.3789000    
 C   -3.879400     -0.8984000      0.8735000    
 C   -5.342300      0.2138000     -0.6950000    
 C   -4.392400      -2.133100      0.4765000    
 C    3.821100     -0.5380000     -0.9620000    
 C    4.326300       1.232700      0.6021000    
 C   -5.855300      -1.021000      -1.092100    
 C   -5.380400      -2.194400     -0.5062000    
 C    4.965100      -1.224200     -0.5547000    
 C    5.470200      0.5466000       1.009600    
 C    5.789600     -0.6819000      0.4312000    
 H   -2.739300       1.812500      -1.162600    
 H   -1.109400       1.624000       1.429300    
 H   -1.419600      0.2792000      0.3219000    
 H   -3.565300       1.570900       1.783400    
 H   -4.614200       2.334500      0.6225000    
 H   -1.638900       3.966800     -0.6183000    
 H   -2.285000       3.901500       1.031600    
 H   -3.377900       4.071900     -0.3537000    
 H  -0.3105000       1.523400      -1.408600    
 H   0.9046000     -5.2700002E-02 -4.9400002E-02
 H    1.258300       1.265200       1.073900    
 H    2.454700       2.505700     -0.7495000    
 H    2.091000       1.221200      -1.881500    
 H   -3.116000     -0.8565000       1.645600    
 H   -5.716600       1.121700      -1.159000    
 H    3.175000     -0.9581000      -1.728500    
 H    4.084700       2.187800       1.059800    
 H   -6.624000      -1.068700      -1.857900    
 H   -5.788200      -3.150100     -0.8246000    
 H    6.103600      0.9802000       1.778900    
 H   -4.393400      -4.037000      0.6538000    
 H    4.586300      -2.639200      -1.787600    
 H    7.355100     -0.8175000       1.524500    


%chk=000003141-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003141

0 1
O -4.616411 -3.234892 1.422295
O 5.292080 -2.594824 -0.807795
O 7.124118 -1.227656 0.645467
N -0.230842 1.618313 -0.369548
C -2.630590 2.156745 0.084841
C -1.407372 1.289548 0.469281
C -3.930874 1.629363 0.768034
C -2.388889 3.642025 0.433503
C 1.019779 0.936650 0.023736
C -4.405196 0.277786 0.250611
C 2.190644 1.365233 -0.897218
C 3.508405 0.715869 -0.505056
C -4.312363 -0.883389 1.051845
C -4.949077 0.164039 -1.059094
C -4.747930 -2.133125 0.554974
C 3.784719 -0.630726 -0.858601
C 4.475268 1.418214 0.251308
C -5.383182 -1.085706 -1.548316
C -5.286380 -2.247351 -0.748145
C 4.983649 -1.267001 -0.472526
C 5.680261 0.790497 0.643844
C 5.946810 -0.549589 0.290258
H -2.772762 2.072777 -1.015071
H -1.138151 1.497522 1.525457
H -1.683599 0.208509 0.413576
H -3.760081 1.581044 1.861744
H -4.725344 2.384645 0.604383
H -1.412867 3.969065 0.035363
H -2.376642 3.787128 1.531519
H -3.181804 4.290530 0.015881
H -0.440331 1.461974 -1.367467
H 0.935455 -0.179823 0.011563
H 1.255361 1.221681 1.067686
H 2.271621 2.466558 -0.855018
H 1.930289 1.101574 -1.943587
H -3.907244 -0.836944 2.068292
H -5.041003 1.058170 -1.687159
H 3.050906 -1.193804 -1.453286
H 4.290616 2.460167 0.535203
H -5.806207 -1.162580 -2.556295
H -5.628037 -3.218021 -1.130804
H 6.423149 1.349857 1.228172
H -4.951823 -4.060893 0.993373
H 4.553591 -2.992212 -1.333598
H 7.713379 -0.630146 1.170274


