%chk=000129266.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129266

0 1
 O   -2.586900      0.2431000      0.4493000    
 O   -1.667500       1.337000      -1.341500    
 O    1.164100      -1.387100      -1.712300    
 O   -2.322200      -2.275400     -0.1015000    
 O    2.576700      0.8814000       1.369700    
 N  -0.7282000     -0.6526000     -0.5774000    
 N    2.492400      0.8934000     -0.9501000    
 N    5.248800       1.555300       1.263000    
 C   -3.613200       1.239700      0.5114000    
 C   -4.373900       1.237400     -0.8138000    
 C   -2.958400       2.597400      0.7614000    
 C   -4.543100      0.8713000       1.665500    
 C   -1.651900      0.4037000     -0.5405000    
 C    1.065400      0.9357000      -1.079800    
 C   0.5533000     -0.4913000      -1.128400    
 C    4.662900      0.8400000      0.1322000    
 C   -1.147200      -1.901100     -9.6199997E-02
 C  -2.5500000E-02  -2.837200      0.3395000    
 C    3.147100      0.8692000      0.2808000    
 C    5.163200     -0.5988000      0.1021000    
 C  -0.4559000      -3.761300       1.466600    
 H   -5.331200       1.761300     -0.7051000    
 H   -4.588000      0.2136000      -1.141900    
 H   -3.859000       1.739600      -1.636600    
 H   -2.195200       2.525700       1.545100    
 H   -2.478300       3.041000     -0.1144000    
 H   -3.707400       3.328600       1.088500    
 H   -3.989300      0.8245000       2.610200    
 H   -4.976800     -0.1235000       1.511700    
 H   -5.359700       1.591800       1.778000    
 H   0.6569000       1.489300     -0.2299000    
 H   0.8240000       1.444100      -2.017200    
 H    4.955300       1.349000     -0.7932000    
 H    3.042700      0.8560000      -1.803200    
 H   0.8350000      -2.261400      0.6964000    
 H   0.2823000      -3.436200     -0.5238000    
 H    4.885300      -1.140000       1.014000    
 H    6.253100     -0.6371000      9.9999997E-05
 H    4.726700      -1.142200     -0.7432000    
 H  -0.8022000      -3.186700       2.332000    
 H   0.3799000      -4.392900       1.783100    
 H   -1.275300      -4.414800       1.149700    
 H    4.977500       2.537200       1.224200    
 H    6.265400       1.538600       1.189700    


%chk=000129266-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129266

0 1
O -2.126567 0.365766 0.655119
O -1.756515 0.564997 -1.659304
O 1.456926 -1.989833 -0.248945
O -2.755686 -2.342604 -0.353866
O 2.666258 2.735443 -0.328522
N -0.756179 -1.185579 -0.364577
N 2.594439 0.427121 -0.396719
N 5.284778 2.819077 0.342086
C -3.186024 1.495484 0.757718
C -4.385632 1.111088 -0.125758
C -2.520005 2.821245 0.348662
C -3.529753 1.452765 2.253379
C -1.614440 0.011245 -0.553907
C 1.145582 0.409693 -0.554811
C 0.648205 -1.029117 -0.377308
C 4.817851 1.529797 -0.178869
C -1.507040 -2.420462 -0.236960
C -0.755527 -3.713214 0.023387
C 3.275827 1.617900 -0.292492
C 5.309875 0.361728 0.713296
C -1.710347 -4.910196 0.172131
H -5.214448 1.814279 0.073300
H -4.728756 0.089604 0.111223
H -4.134888 1.161801 -1.196811
H -1.623186 3.018960 0.962004
H -2.235498 2.818295 -0.715340
H -3.234296 3.647990 0.514583
H -2.632113 1.637378 2.867796
H -3.948942 0.470415 2.528970
H -4.277559 2.232358 2.482832
H 0.671268 1.085897 0.184429
H 0.841354 0.789522 -1.550766
H 5.172626 1.329224 -1.222950
H 3.054459 -0.482941 -0.299536
H -0.120569 -3.583163 0.920264
H -0.029267 -3.872336 -0.796122
H 4.874974 0.444305 1.723530
H 6.408211 0.421156 0.813321
H 5.076272 -0.634280 0.288450
H -2.407173 -4.765496 1.015155
H -1.128432 -5.831306 0.351552
H -2.319212 -5.050975 -0.736860
H 4.609120 3.575597 0.185798
H 6.251726 3.056671 0.115639


