%chk=000022509.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022509

0 1
 O    1.532500     -0.9799000      2.4000000E-02
 O   0.4573000       1.039400     -6.8499997E-02
 N  -0.8032000     -0.9402000      9.0899996E-02
 C    4.738800      0.6344000      0.6396000    
 C    3.741800     -0.4716000      0.9927000    
 C    4.506100      0.9739000     -0.8357000    
 C    2.724400     -0.3265000     -8.2500003E-02
 C    3.127600      0.4598000      -1.085000    
 C   0.3918000     -0.1851000      2.3200000E-02
 C   -2.082700     -0.2645000      5.2900001E-02
 C  -0.7552000      -2.405700      0.1996000    
 C   -2.158000       1.003600      0.5649000    
 C   -3.147900     -0.9295000     -0.4937000    
 C   -3.390800       1.655100      0.5280000    
 C   -4.380600     -0.2778000     -0.5306000    
 C   -4.502000       1.014500     -1.9800000E-02
 H    5.773400      0.3332000      0.8336000    
 H    4.540200       1.520500       1.256900    
 H    3.320500     -0.3194000       1.990700    
 H    4.210100      -1.460300      0.9479000    
 H    5.225500      0.4633000      -1.484100    
 H    4.575900       2.052000      -1.006800    
 H    2.555700      0.6763000      -1.975500    
 H   0.1735000      -2.738300      0.6705000    
 H  -0.8108000      -2.831900     -0.8065000    
 H   -1.584800      -2.767200      0.8150000    
 H   -1.355800       1.514900       1.081700    
 H   -3.076600      -1.927300     -0.9130000    
 H   -3.491100       2.653600      0.9440000    
 H   -5.245600     -0.7752000     -0.9597000    
 H   -5.462800       1.520300     -4.5100000E-02


%chk=000022509-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000022509

0 1
O 1.479024 -0.593629 0.252854
O 0.309545 1.335140 -0.427413
N -0.820554 -0.626214 0.286177
C 5.152359 -0.075289 0.327624
C 3.903565 -1.009652 0.362818
C 4.702717 1.209785 -0.448822
C 2.771891 -0.044347 0.063624
C 3.181990 1.172648 -0.381638
C 0.299420 0.155187 -0.003517
C -2.160891 -0.143807 0.045613
C -0.665666 -2.018841 0.773861
C -2.484883 1.241546 0.053634
C -3.200687 -1.090329 -0.168440
C -3.818617 1.653655 -0.147174
C -4.530801 -0.662640 -0.365940
C -4.852112 0.712157 -0.355991
H 6.026052 -0.562919 -0.137335
H 5.434543 0.200243 1.359507
H 3.775100 -1.514935 1.337812
H 3.949481 -1.802560 -0.410380
H 5.044406 1.190257 -1.504386
H 5.120965 2.130088 0.000765
H 2.531799 1.990264 -0.688860
H 0.317233 -2.130901 1.245712
H -0.739617 -2.750229 -0.052995
H -1.453768 -2.230060 1.515321
H -1.698765 1.983019 0.196754
H -2.980538 -2.160953 -0.200259
H -4.047835 2.725157 -0.135798
H -5.313608 -1.410823 -0.533851
H -5.884549 1.043381 -0.509676


