%chk=000013917.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013917

0 1
 O    2.029300      0.4602000     -0.9173000    
 O    2.451600     -0.4165000       1.194400    
 N    4.099600     -0.4049000     -0.4385000    
 C   -2.627400     -0.9174000     -0.4740000    
 C   -1.536700      0.1208000     -0.2737000    
 C   -2.356300      -2.235000      0.2806000    
 C   -2.838500      -1.193100      -1.967800    
 C   -1.838300       1.337300      0.3081000    
 C  -0.2554000     -0.1917000     -0.6887000    
 C   -2.312800      -2.059700       1.793700    
 C  -0.8216000       2.276400      0.4820000    
 C   0.7611000      0.7475000     -0.5150000    
 C   -3.222000       1.675900      0.7562000    
 C   0.4781000       1.981400      7.0299998E-02
 C    2.837700     -0.1532000      5.9300002E-02
 C    5.151700      -1.028000      0.3304000    
 H   -3.592800     -0.5546000     -0.1085000    
 H   -1.420600      -2.699000     -5.2800000E-02
 H   -3.154500      -2.950700      4.5499999E-02
 H   -1.967100      -1.669700      -2.429400    
 H   -3.694400      -1.860600      -2.117500    
 H   -3.042200     -0.2648000      -2.513500    
 H  -1.9600000E-02  -1.147600      -1.147100    
 H   -2.190300      -3.032800       2.279900    
 H   -1.475600      -1.426700       2.102800    
 H   -3.240900      -1.612800       2.163900    
 H   -1.024400       3.242700      0.9360000    
 H   -3.267900       2.682800       1.187000    
 H   -3.919600       1.663800     -8.7700002E-02
 H   -3.560800      0.9854000       1.535300    
 H    1.265300       2.717700      0.2080000    
 H    4.299700     -0.1375000      -1.397400    
 H    5.993100     -0.3327000      0.3828000    
 H    5.464700      -1.935000     -0.1924000    
 H    4.814100      -1.278700       1.338700    


%chk=000013917-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013917

0 1
O 2.219312 0.715748 0.003747
O 2.342092 -1.623785 -0.482191
N 4.233596 -0.251776 -0.248483
C -2.524352 -1.001162 -0.361281
C -1.535394 0.141438 -0.090490
C -2.375676 -2.161902 0.668253
C -2.378428 -1.534776 -1.812383
C -1.969251 1.464376 0.222537
C -0.147027 -0.146332 -0.168747
C -2.684418 -1.742956 2.121351
C -0.986091 2.464026 0.447799
C 0.800587 0.871305 0.060336
C -3.441367 1.836528 0.324184
C 0.391564 2.185250 0.370998
C 2.882147 -0.510760 -0.266958
C 5.228472 -1.298944 -0.488348
H -3.553414 -0.607886 -0.254043
H -1.347946 -2.571625 0.609088
H -3.057508 -2.982301 0.365213
H -1.382215 -1.986620 -1.972005
H -3.139398 -2.310568 -2.019157
H -2.500799 -0.722985 -2.552244
H 0.196540 -1.154214 -0.406260
H -2.572838 -2.596486 2.814976
H -2.001173 -0.941726 2.457057
H -3.721429 -1.366486 2.214924
H -1.308059 3.483986 0.689251
H -3.555615 2.908534 0.560765
H -3.984722 1.644910 -0.620403
H -3.958030 1.263395 1.117124
H 1.145426 2.958811 0.544183
H 4.522799 0.707719 -0.058370
H 5.897244 -1.423967 0.383222
H 5.840871 -1.074558 -1.381313
H 4.690800 -2.245011 -0.658731


