%chk=000022639.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022639

0 1
 O   -2.729100       1.372400      1.5300000E-02
 N    2.031400      0.7248000      0.2159000    
 C   0.7305000      0.1854000      0.1110000    
 C   0.5353000      -1.191700      5.1000002E-03
 C  -0.3664000       1.047100      0.1144000    
 C  -0.7568000      -1.706900     -9.7499996E-02
 C   -1.658500      0.5318000      1.1600000E-02
 C    1.691700      -2.137800     -1.2000001E-03
 C   -1.853700     -0.8452000     -9.4200000E-02
 C    2.375500       2.020100     -0.2804000    
 H  -0.2441000       2.123100      0.2048000    
 H  -0.9272000      -2.777100     -0.1802000    
 H    2.229600      -2.092500      0.9515000    
 H    1.367300      -3.174800     -0.1422000    
 H    2.378800      -1.902600     -0.8209000    
 H    2.792000      7.6099999E-02  0.3827000    
 H   -2.855200      -1.259200     -0.1745000    
 H    2.055100       2.151600      -1.319200    
 H    3.462600       2.147900     -0.2528000    
 H    1.942600       2.815100      0.3350000    
 H   -3.543200      0.8460000     -6.3500002E-02


%chk=000022639-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000022639

0 1
O -2.725206 1.456634 -0.105127
N 2.054552 0.671939 -0.068188
C 0.752117 0.167855 -0.057501
C 0.544832 -1.256781 -0.011634
C -0.366575 1.043601 -0.087982
C -0.778099 -1.738827 0.001016
C -1.672698 0.515122 -0.072880
C 1.731548 -2.202773 0.025293
C -1.902059 -0.877997 -0.028962
C 2.368712 2.096116 -0.118573
H -0.247385 2.129128 -0.123776
H -0.941130 -2.822953 0.036138
H 2.372430 -2.032995 0.915237
H 1.395604 -3.252638 0.062805
H 2.377168 -2.101158 -0.872135
H 2.823664 0.007283 -0.071923
H -2.919900 -1.286507 -0.017543
H 1.975319 2.577110 -1.038012
H 3.463371 2.229075 -0.107593
H 1.950032 2.640233 0.752219
H -3.598098 0.992134 -0.090178


