%chk=000092025.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092025

0 1
 O    1.032700      -2.867700     -0.5644000    
 O    1.440300      0.8247000       2.260100    
 O   -4.729800     -0.4066000      -1.233200    
 O   -4.500600       1.647600      0.3394000    
 N    1.336300      -1.008100      0.8134000    
 C    3.685400     -0.7468000      2.0099999E-02
 C    2.713300      -1.344900       1.052000    
 C    3.588700      0.7936000     -9.2000000E-02
 C    5.158400      -1.135500      0.2869000    
 C    4.468700       1.453500      -1.160000    
 C   -1.337500     -0.2871000      0.2612000    
 C   0.5880000      -1.841500     -5.4200001E-02
 C   0.8096000      0.1371000       1.460100    
 C  -0.8053000      -1.435500     -0.3414000    
 C  -0.5885000      0.5042000       1.143200    
 C    4.390400       2.980300      -1.157100    
 C    5.404000      -2.637500      0.3217000    
 C   -2.674800      8.3400004E-02 -2.8000001E-02
 C   -1.578500      -2.208200      -1.217100    
 C   -1.148500       1.644800       1.732600    
 C   -3.436200     -0.7007000     -0.9078000    
 C   -3.220900       1.229100      0.5698000    
 C    5.201500       3.579000      -2.296000    
 C   -2.890600      -1.838600      -1.497800    
 C   -2.461900       2.003700       1.444200    
 C   -5.745800     -0.9708000     -0.4093000    
 C   -4.698400       2.548400     -0.7464000    
 H    3.412300      -1.153100     -0.9640000    
 H    3.004400      -1.011000       2.055500    
 H    2.800500      -2.436700       1.054400    
 H    2.555200       1.076500     -0.3211000    
 H    3.828800       1.235500      0.8836000    
 H    5.499400     -0.6926000       1.230100    
 H    5.805000     -0.7477000     -0.5050000    
 H    5.520200       1.192000      -1.011800    
 H    4.178100       1.068600      -2.145100    
 H    4.759100       3.370000     -0.2013000    
 H    3.346000       3.298000      -1.256300    
 H    6.478800      -2.840300      0.3731000    
 H    5.010600      -3.122600     -0.5772000    
 H    4.943800      -3.100300       1.199400    
 H   -1.176300      -3.099700      -1.690800    
 H  -0.5781000       2.266400       2.417600    
 H    4.831100       3.233200      -3.266300    
 H    5.132800       4.671200      -2.276200    
 H    6.257700       3.303600      -2.212800    
 H   -3.481700      -2.444200      -2.179800    
 H   -2.887300       2.890200       1.907500    
 H   -6.683800     -0.4473000     -0.6136000    
 H   -5.876500      -2.029100     -0.6557000    
 H   -5.511000     -0.8678000      0.6552000    
 H   -4.157300       2.230100      -1.643400    
 H   -4.372500       3.552600     -0.4580000    
 H   -5.767200       2.581400     -0.9749000    


%chk=000092025-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092025

0 1
O 1.316688 -2.566887 -0.635329
O 1.351696 0.849752 2.551494
O -4.790687 -0.588329 -1.351069
O -4.662851 1.712994 0.369393
N 1.354057 -0.819670 0.910708
C 3.777390 -0.665672 0.143018
C 2.772984 -1.155847 1.222492
C 3.864153 0.883897 0.104110
C 5.164681 -1.315806 0.411356
C 4.487740 1.443970 -1.195214
C -1.389228 -0.207556 0.289779
C 0.700669 -1.612207 -0.069813
C 0.723727 0.224251 1.643968
C -0.713234 -1.276404 -0.383973
C -0.687814 0.536814 1.293556
C 4.586182 2.986955 -1.200686
C 5.248233 -2.814940 0.044031
C -2.769985 0.110729 -0.033931
C -1.381922 -2.029952 -1.359800
C -1.328250 1.587272 1.967602
C -3.439159 -0.746960 -0.988503
C -3.357052 1.256001 0.628819
C 5.191543 3.546643 -2.506210
C -2.742420 -1.770470 -1.648960
C -2.652172 1.949603 1.624632
C -5.788937 -1.005404 -0.336636
C -4.871493 2.394818 -0.931075
H 3.417325 -1.027630 -0.841611
H 2.999044 -0.685487 2.194227
H 2.830047 -2.253166 1.315636
H 2.851504 1.318507 0.220398
H 4.446457 1.238165 0.980793
H 5.429505 -1.173081 1.480404
H 5.931192 -0.766619 -0.169061
H 5.501342 1.020346 -1.349400
H 3.878955 1.113622 -2.063263
H 5.198473 3.314918 -0.335894
H 3.575503 3.416461 -1.043740
H 6.261416 -3.213746 0.236455
H 5.017051 -2.968880 -1.026133
H 4.533536 -3.426862 0.623290
H -0.835305 -2.833503 -1.863192
H -0.770318 2.130262 2.736803
H 4.578213 3.260939 -3.381878
H 5.256252 4.650243 -2.484200
H 6.211958 3.151139 -2.670198
H -3.291503 -2.372762 -2.378446
H -3.152979 2.791689 2.110916
H -6.766250 -0.865507 -0.822457
H -5.641905 -2.072596 -0.084325
H -5.721193 -0.370912 0.563130
H -4.718383 1.693987 -1.768755
H -4.194185 3.266154 -1.009455
H -5.918194 2.733520 -0.910704


