%chk=000123545.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000123545

0 1
 O  -0.8152000       2.441700      0.4531000    
 O  -0.3169000      -2.067000     -0.3809000    
 O    4.059900      0.4064000      -2.266900    
 O    4.051100     -0.4470000       2.262300    
 N  -0.1330000      0.2351000      4.0500000E-02
 N    4.023500      8.8000000E-03  3.1000001E-03
 C    1.298300      0.4024000      7.1599998E-02
 C   -2.358600      0.6557000      0.1240000    
 C   -2.213000     -0.6486000     -0.1228000    
 C   -3.662000       1.355800      0.2405000    
 C   -3.332200      -1.609900     -0.2854000    
 C   -4.811400      0.4703000     -0.2696000    
 C   -4.662300     -0.9917000      0.1773000    
 C   -1.025000       1.261100      0.2330000    
 C  -0.7775000     -0.9568000     -0.1783000    
 C    1.920800      1.7600000E-02  -1.262800    
 C    1.915500     -0.4393000       1.178400    
 C    3.421400      0.1840000      -1.238500    
 C    3.416600     -0.2787000       1.221300    
 H    1.523100       1.459200      0.2697000    
 H   -3.835800       1.611200       1.292400    
 H   -3.649500       2.293100     -0.3266000    
 H   -3.407800      -1.892100      -1.342100    
 H   -3.141800      -2.525200      0.2856000    
 H   -5.767700      0.8730000      8.3300002E-02
 H   -4.837900      0.5061000      -1.366500    
 H   -5.496800      -1.587500     -0.2097000    
 H   -4.721700      -1.036700       1.272600    
 H    1.516400      0.6519000      -2.060600    
 H    1.716000      -1.024000      -1.533600    
 H    1.710300      -1.508300       1.054600    
 H    1.508800     -0.1354000       2.150400    
 H    5.035400      0.1023000      2.2700001E-02


%chk=000123545-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000123545

0 1
O -0.750120 2.473471 0.469526
O -0.272819 -2.122164 -0.389458
O 4.190398 0.423959 -2.284545
O 4.205307 -0.427860 2.271190
N -0.123604 0.215768 0.047099
N 4.115813 0.015332 -0.003121
C 1.336754 0.395316 0.076940
C -2.428275 0.660249 0.131217
C -2.286337 -0.676226 -0.123259
C -3.741858 1.377016 0.251800
C -3.421598 -1.643228 -0.296729
C -4.883577 0.476125 -0.294194
C -4.746674 -0.992340 0.188026
C -1.061666 1.277244 0.247681
C -0.818583 -1.005705 -0.183434
C 1.980011 0.033556 -1.283669
C 1.987771 -0.431556 1.211838
C 3.495966 0.181983 -1.264015
C 3.503996 -0.285348 1.236729
H 1.488194 1.474370 0.277241
H -3.924920 1.637033 1.314685
H -3.701886 2.343318 -0.286222
H -3.498822 -1.934052 -1.364674
H -3.211810 -2.582235 0.250277
H -5.861530 0.885593 0.018409
H -4.863090 0.496876 -1.401751
H -5.605642 -1.588392 -0.170788
H -4.777914 -1.014803 1.295329
H 1.595409 0.670623 -2.096730
H 1.738096 -1.016494 -1.538980
H 1.744203 -1.502845 1.073442
H 1.609626 -0.129998 2.202265
H 5.140182 0.102915 0.009978


