%chk=000025262.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025262

0 1
 O  -0.2989000      -1.670200     -0.8742000    
 O   -1.873000       1.043800      -2.171200    
 N    4.480800      -1.194500     -0.2504000    
 C    2.067700      -1.445600     -0.5822000    
 C    3.267600      -1.792800      0.2933000    
 C   0.7803000      -2.039300     -2.6799999E-02
 C   -1.532700      -1.552300     -0.2887000    
 C   -2.218700     -0.3428000     -0.3195000    
 C    5.631400      -1.495400      0.6034000    
 C    4.321500      0.2535000     -0.3954000    
 C   -1.650800      0.8292000     -0.9712000    
 C   -2.087000      -2.663900      0.3374000    
 C   -3.473000     -0.2435000      0.2825000    
 C  -0.7919000       1.810300     -0.2439000    
 C   -3.341300      -2.564600      0.9394000    
 C   -4.034400      -1.354400      0.9120000    
 C  -0.5281000       1.595100       1.089200    
 C  -0.2964000       2.891100     -0.9365000    
 C   0.2759000       2.511400       1.767300    
 C   0.5075000       3.807300     -0.2584000    
 C   0.7937000       3.617500       1.093600    
 H    1.897400     -0.3655000     -0.6501000    
 H    2.220400      -1.798100      -1.610300    
 H    3.377800      -2.883900      0.3264000    
 H    3.085300      -1.452600       1.321400    
 H   0.6176000      -1.673200      0.9954000    
 H   0.8516000      -3.132700      6.0000003E-04
 H    5.767800      -2.578500      0.6972000    
 H    5.522300      -1.072700       1.608900    
 H    6.553400      -1.101900      0.1611000    
 H    5.286800      0.7215000     -0.6257000    
 H    3.935000      0.7287000      0.5139000    
 H    3.681400      0.5116000      -1.244800    
 H   -1.563000      -3.615100      0.3589000    
 H   -4.023000      0.6940000      0.2676000    
 H   -3.779500      -3.430100       1.427900    
 H   -5.011200      -1.277400       1.380400    
 H  -0.9109000      0.7471000       1.646200    
 H  -0.5045000       3.059800      -1.988300    
 H   0.4997000       2.363400       2.819800    
 H   0.9112000       4.668500     -0.7828000    
 H    1.420100       4.330500       1.621500    


%chk=000025262-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025262

0 1
O -0.195187 -0.792832 -0.108585
O -2.959265 1.440466 -1.879171
N 4.705981 -1.320272 -0.204588
C 2.205313 -1.011663 -0.120469
C 3.430947 -1.817242 0.361527
C 0.899184 -1.707381 0.270217
C -1.513823 -1.176320 0.156041
C -2.531351 -0.253352 -0.237251
C 5.821060 -2.250936 0.066749
C 5.032154 0.060307 0.208302
C -2.254991 1.080705 -0.883363
C -1.865380 -2.424831 0.729917
C -3.887462 -0.640131 -0.093197
C -1.222499 2.012873 -0.319477
C -3.225512 -2.763851 0.898003
C -4.244179 -1.877644 0.480646
C -0.802612 1.942702 1.034376
C -0.712244 3.042190 -1.154098
C 0.114253 2.885710 1.544696
C 0.217904 3.973091 -0.649761
C 0.632540 3.898253 0.702323
H 2.197928 0.003095 0.316689
H 2.255404 -0.901821 -1.218488
H 3.319948 -2.872492 0.039736
H 3.451356 -1.822154 1.486180
H 0.859524 -1.902055 1.363242
H 0.777981 -2.670354 -0.267948
H 5.577751 -3.251241 -0.334525
H 6.054392 -2.362831 1.157208
H 6.734645 -1.893442 -0.440842
H 5.985716 0.364281 -0.258485
H 5.137625 0.174044 1.318659
H 4.253002 0.760019 -0.136745
H -1.092460 -3.137425 1.031011
H -4.655161 0.057895 -0.443251
H -3.485500 -3.730350 1.344313
H -5.298037 -2.148545 0.597858
H -1.207286 1.161356 1.686589
H -1.063054 3.093209 -2.190158
H 0.422437 2.836481 2.595086
H 0.616106 4.758140 -1.302047
H 1.348749 4.627647 1.097982


