%chk=000026750.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026750

0 1
 O   -1.411600      0.1177000      -2.340400    
 N    1.077400       1.371200      -2.505500    
 C  -0.9523000     -0.5653000      -1.169700    
 C   0.1160000      0.3207000     -0.4575000    
 C  -0.3252000      -1.914300      -1.629400    
 C   -2.171200     -0.8150000     -0.2354000    
 C    1.396900      0.6797000      -1.254500    
 C   0.1906000      -2.814100     -0.5269000    
 C   -2.872000      0.4225000      0.2820000    
 C    2.361100       1.489900     -0.3988000    
 C    1.504100      -2.686600     -0.1101000    
 C   -2.451900      0.9885000       1.473100    
 C  -0.6624000      -3.744900      3.9900001E-02
 C   -3.918000      0.9613000     -0.4469000    
 C    2.261100       2.865800     -0.4036000    
 C    3.305100      0.8234000      0.3546000    
 C    1.979500      -3.515700      0.9057000    
 C   -3.097800       2.129000       1.950200    
 C  -0.1870000      -4.574100       1.055800    
 C   -4.563900       2.101800      3.0200001E-02
 C    3.144400       3.608200      0.3801000    
 C    4.188500       1.565800       1.138300    
 C    1.134100      -4.459500       1.488800    
 C   -4.153700       2.685800       1.228800    
 C    4.108200       2.958200       1.151100    
 H  -0.3481000       1.282100     -0.1997000    
 H   0.3978000     -0.1390000      0.4985000    
 H   -1.078100      -2.466700      -2.210900    
 H   0.4689000      -1.738100      -2.366700    
 H   -1.871900      -1.402900      0.6400000    
 H   -2.912700      -1.426600     -0.7681000    
 H    1.919500     -0.2275000      -1.561400    
 H   -1.653400       1.025100      -2.090000    
 H   0.4700000      0.7861000      -3.077300    
 H    1.929100       1.505600      -3.050000    
 H    2.195100      -2.001300     -0.5783000    
 H   -1.634200      0.5611000       2.046100    
 H   -1.691200      -3.846900     -0.2929000    
 H   -4.244400      0.5144000      -1.381300    
 H    1.508900       3.396300     -0.9789000    
 H    3.381500     -0.2579000      0.3545000    
 H    3.011500      -3.434400       1.234700    
 H   -2.779000       2.583000       2.884000    
 H  -0.8448000      -5.310200       1.508600    
 H   -5.386000       2.535400     -0.5316000    
 H    3.079300       4.692300      0.3938000    
 H    4.938900       1.059700       1.738600    
 H    1.505200      -5.107100       2.277700    
 H   -4.656700       3.573800       1.600300    
 H    4.795200       3.536300       1.762200    


%chk=000026750-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000026750

0 1
O -1.450281 0.077623 -2.254875
N 1.014010 1.500737 -2.490458
C -0.863762 -0.549425 -1.031459
C 0.221491 0.381081 -0.420074
C -0.318304 -1.906146 -1.573696
C -2.018963 -0.806024 0.001141
C 1.452217 0.734763 -1.309637
C 0.149242 -2.903129 -0.520747
C -2.820034 0.432905 0.371158
C 2.451149 1.551075 -0.478205
C 1.457441 -2.844833 0.028476
C -2.501195 1.202450 1.521690
C -0.716898 -3.935111 -0.070621
C -3.909586 0.855556 -0.439484
C 2.271566 2.947381 -0.309786
C 3.543326 0.920391 0.167280
C 1.882197 -3.774411 1.003736
C -3.238497 2.362240 1.848070
C -0.298179 -4.868110 0.904331
C -4.648032 2.017874 -0.117127
C 3.161841 3.694128 0.492788
C 4.435843 1.663980 0.973083
C 1.004132 -4.789215 1.449268
C -4.312494 2.777758 1.026490
C 4.246165 3.055253 1.140394
H -0.255927 1.335603 -0.125682
H 0.597057 -0.086895 0.509722
H -1.140665 -2.345402 -2.168021
H 0.498664 -1.682497 -2.283793
H -1.576884 -1.263546 0.904301
H -2.691768 -1.557742 -0.453840
H 1.965258 -0.222357 -1.580779
H -1.908933 0.913605 -1.972299
H 0.211857 1.071943 -2.967392
H 1.777784 1.777548 -3.114151
H 2.152966 -2.072500 -0.320374
H -1.675023 0.885134 2.169671
H -1.724729 -4.013076 -0.497051
H -4.195934 0.252910 -1.310170
H 1.439082 3.428189 -0.835046
H 3.703744 -0.157627 0.031521
H 2.897889 -3.711464 1.410939
H -2.977886 2.939356 2.742477
H -0.983519 -5.657492 1.233491
H -5.486711 2.324326 -0.752698
H 3.014167 4.773863 0.613105
H 5.279246 1.162784 1.462096
H 1.332752 -5.513032 2.203405
H -4.885413 3.676712 1.279872
H 4.938929 3.635467 1.760761


