%chk=000023551.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023551

0 1
 O   -1.959900      2.0199999E-02  0.4930000    
 O   -1.927100       2.171000     -0.3268000    
 N   -5.856300      -1.199500     -0.4296000    
 N    4.269400      0.6135000      0.1356000    
 C   -3.381600      3.4100000E-02  0.5160000    
 C   -3.924000      0.2722000     -0.8905000    
 C   -3.882800      -1.301600       1.055800    
 C   -5.443900      0.1187000     -0.9329000    
 C   -5.403900      -1.407400      0.9535000    
 C   -7.308300      -1.350700     -0.5212000    
 C   -1.358000       1.157500      4.7899999E-02
 C   0.1196000       1.014600      7.1500003E-02
 C    6.446900     -0.4607000     -3.1700000E-02
 C    4.931500     -0.6416000     -4.2700000E-02
 C    2.865800      0.7491000      0.1139000    
 C   0.8951000       2.137800      0.2732000    
 C   0.6716000     -0.2371000     -0.1098000    
 C    7.199600      -1.772900     -0.2662000    
 C    2.283300       2.003600      0.2946000    
 C    2.059800     -0.3714000     -8.8299997E-02
 C    8.703200      -1.549400     -0.3152000    
 H   -3.717000      0.8337000       1.189900    
 H   -3.695900       1.264900      -1.283400    
 H   -3.457300     -0.4353000      -1.589600    
 H   -3.410200      -2.126100      0.5051000    
 H   -3.565400      -1.422200       2.098700    
 H   -5.912700      0.9238000     -0.3516000    
 H   -5.770800      0.2349000      -1.973500    
 H   -5.700500      -2.406600       1.294800    
 H   -5.870100     -0.6796000       1.630900    
 H   -7.612400      -2.351200     -0.1939000    
 H   -7.641300      -1.246500      -1.559800    
 H   -7.841100     -0.6116000      8.7899998E-02
 H    6.757700     -2.6699999E-02  0.9273000    
 H    6.730500      0.2638000     -0.8063000    
 H    4.645300      -1.089800      -1.002100    
 H    4.652600      -1.338000      0.7573000    
 H   0.4533000       3.119100      0.4184000    
 H   6.6399999E-02  -1.122100     -0.2822000    
 H    6.873700      -2.224900      -1.210100    
 H    6.963400      -2.483800      0.5338000    
 H    4.815600       1.452800      0.2958000    
 H    2.900100       2.884400      0.4538000    
 H    2.470800      -1.365800     -0.2341000    
 H    9.066900      -1.122600      0.6249000    
 H    9.222100      -2.498700     -0.4808000    
 H    8.972600     -0.8687000      -1.129100    


%chk=000023551-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023551

0 1
O -2.029803 -0.102524 0.324712
O -1.927194 2.232736 0.430623
N -6.092924 -1.120095 -0.451323
N 4.352875 0.582238 -0.003841
C -3.520228 -0.021065 0.385062
C -4.099626 0.271490 -1.010064
C -4.017496 -1.371470 0.911676
C -5.640367 0.198088 -0.958661
C -5.561483 -1.393770 0.905554
C -7.559339 -1.268645 -0.514096
C -1.335871 1.121665 0.343032
C 0.127958 0.935553 0.253061
C 6.611610 -0.420062 -0.159868
C 5.095424 -0.681685 -0.071964
C 2.971378 0.681466 0.079639
C 0.961764 2.089843 0.248851
C 0.737587 -0.344530 0.168598
C 7.436106 -1.726211 -0.194998
C 2.352740 1.970732 0.162946
C 2.132976 -0.477753 0.084544
C 8.955146 -1.468175 -0.286198
H -3.786641 0.802401 1.076892
H -3.780528 1.272084 -1.351185
H -3.722177 -0.485295 -1.722336
H -3.637473 -2.178439 0.258915
H -3.639212 -1.546579 1.935626
H -6.030646 1.036213 -0.320429
H -6.053349 0.343146 -1.974180
H -5.919713 -2.389155 1.227910
H -5.945671 -0.646486 1.652207
H -7.845124 -2.288614 -0.199453
H -7.903709 -1.122620 -1.553687
H -8.108152 -0.539956 0.136546
H 6.929382 0.189071 0.711906
H 6.829571 0.177214 -1.069059
H 4.769876 -1.269131 -0.957210
H 4.879046 -1.302634 0.824347
H 0.486281 3.074314 0.314192
H 0.099961 -1.233393 0.170187
H 7.112296 -2.340809 -1.059170
H 7.215121 -2.321807 0.713634
H 4.896123 1.445729 0.006773
H 2.981264 2.870379 0.159650
H 2.576061 -1.476070 0.022018
H 9.311868 -0.881590 0.581199
H 9.522162 -2.416328 -0.308130
H 9.208449 -0.902271 -1.202249


