%chk=000038072.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038072

0 1
 O  -0.1190000      -3.285300      0.1128000    
 O   0.2311000       4.321100     -5.3800002E-02
 O   9.2200004E-02   2.606100       1.430900    
 N   1.7800000E-02  0.7156000     -0.4884000    
 C   -1.243500      0.1190000     -0.2618000    
 C    1.235400      3.4299999E-02 -0.2621000    
 C   -1.322100      -1.266500     -2.0400001E-02
 C    1.219200      -1.353400     -2.0700000E-02
 C  -7.7299997E-02  -2.064900      2.3700001E-02
 C   6.5099999E-02   2.112900     -0.9285000    
 C   -2.454200      0.8357000     -0.2451000    
 C    2.492300      0.6665000     -0.2460000    
 C   -2.549100      -1.911200      0.1914000    
 C    2.399300      -2.080700      0.1904000    
 C   -3.680700      0.1976000     -2.9800000E-02
 C    3.672300     -5.4299999E-02 -3.1300001E-02
 C   -3.728600      -1.174900      0.1824000    
 C    3.626300      -1.426800      0.1809000    
 C   0.1234000       3.009200      0.2753000    
 H  -0.7995000       2.383800      -1.543900    
 H   0.9320000       2.307300      -1.570100    
 H   -2.485900       1.912100     -0.3861000    
 H    2.597400       1.737900     -0.3903000    
 H   -2.601800      -2.981300      0.3728000    
 H    2.378700      -3.151800      0.3716000    
 H   -4.598400      0.7792000     -2.5300000E-02
 H    4.627600      0.4630000     -2.8100001E-02
 H   -4.681300      -1.668200      0.3496000    
 H    4.543100      -1.984200      0.3474000    
 H   0.2756000       4.895000      0.7404000    


%chk=000038072-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038072

0 1
O -0.125612 -3.418942 0.217054
O 0.206781 4.415753 -0.185243
O 0.077469 2.873106 1.556438
N 0.023915 0.719886 -0.397710
C -1.232014 0.095792 -0.206059
C 1.231593 0.006470 -0.208086
C -1.303476 -1.318715 0.005921
C 1.200867 -1.409410 0.004727
C -0.079730 -2.149550 0.078568
C 0.075855 2.117167 -0.821222
C -2.444591 0.846627 -0.226122
C 2.495348 0.667568 -0.232337
C -2.568733 -1.944125 0.160705
C 2.417787 -2.124556 0.158207
C -3.683450 0.202562 -0.070027
C 3.684592 -0.064486 -0.077149
C -3.757478 -1.202418 0.116979
C 3.657031 -1.470865 0.112028
C 0.117314 3.118905 0.338212
H -0.795105 2.359047 -1.453150
H 0.956371 2.292987 -1.461169
H -2.436304 1.935286 -0.323297
H 2.565535 1.753660 -0.333842
H -2.565446 -3.028186 0.316122
H 2.336602 -3.205528 0.314027
H -4.600098 0.802764 -0.080693
H 4.642269 0.467745 -0.091370
H -4.727683 -1.693926 0.238006
H 4.589426 -2.030995 0.231819
H 0.228368 5.079177 0.556563


