%chk=000121679.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121679

0 1
 O    2.214300       3.046200      0.7191000    
 O  -8.0600001E-02   2.510300     -0.4770000    
 O   -6.524100      -1.576700      0.2146000    
 N  -0.8360000      0.3427000      8.8000000E-03
 C    3.168000     -0.8996000     -0.2420000    
 C    4.173500     -1.2700000E-02  0.2112000    
 C    1.523300      0.8822000     -4.3699998E-02
 C    1.847600     -0.4366000     -0.3637000    
 C    2.512200       1.754400      0.4016000    
 C    3.828900       1.311200      0.5289000    
 C   0.1432000       1.326000     -0.1831000    
 C    3.512100      -2.223600     -0.5597000    
 C    5.493700     -0.4760000      0.3332000    
 C   -2.243500      0.4717000     -8.5100003E-02
 C    4.829000      -2.666700     -0.4329000    
 C   -3.041400     -0.6361000      0.1446000    
 C    5.817800      -1.794600      1.2900000E-02
 C   -4.427400     -0.5084000      5.2000001E-02
 C   -2.789500       1.703200     -0.4047000    
 C   -4.994300      0.7252000     -0.2689000    
 C   -4.175400       1.830900     -0.4971000    
 C   -5.281900      -1.660700      0.2899000    
 C   -4.669600      -3.012400      0.6410000    
 H    1.100400      -1.125400     -0.7523000    
 H    4.596800       1.999400      0.8782000    
 H    2.756000      -2.923300     -0.9096000    
 H    6.283000      0.1880000      0.6795000    
 H  -0.5327000     -0.5860000      0.2898000    
 H   -2.570100      -1.582300      0.3921000    
 H    5.082000      -3.693100     -0.6820000    
 H    6.842700      -2.140300      0.1115000    
 H   -2.225500       2.603800     -0.5952000    
 H   -6.071100      0.8499000     -0.3469000    
 H   -4.618000       2.790900     -0.7469000    
 H    3.025200       3.498700       1.007900    
 H   -4.111100      -2.942700       1.578000    
 H   -4.032500      -3.362600     -0.1752000    
 H   -5.472500      -3.743500      0.7801000    


%chk=000121679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000121679

0 1
O 1.931931 2.678342 1.379430
O -0.048429 2.445154 -0.883598
O -6.647488 -1.518136 0.374376
N -0.865093 0.416316 -0.009446
C 3.318574 -0.879155 -0.484038
C 4.233789 -0.108564 0.332496
C 1.535979 0.785040 -0.052372
C 1.978264 -0.400469 -0.649294
C 2.453525 1.535550 0.764861
C 3.767160 1.095412 0.950748
C 0.152293 1.318654 -0.348921
C 3.778041 -2.086218 -1.104714
C 5.576819 -0.582896 0.500093
C -2.268462 0.540627 -0.209659
C 5.092302 -2.524484 -0.924628
C -3.090379 -0.523540 0.243706
C 5.996431 -1.765201 -0.115046
C -4.495350 -0.475937 0.076333
C -2.862698 1.669490 -0.837128
C -5.083677 0.653639 -0.555206
C -4.265490 1.708167 -1.002011
C -5.395241 -1.587026 0.546314
C -4.777333 -2.800958 1.235826
H 1.294240 -0.964797 -1.295358
H 4.456761 1.669031 1.584325
H 3.082752 -2.661717 -1.727547
H 6.273881 -0.004022 1.117499
H -0.553803 -0.427538 0.478628
H -2.624545 -1.390402 0.728703
H 5.437528 -3.447473 -1.402177
H 7.025190 -2.117106 0.018915
H -2.227231 2.489505 -1.175872
H -6.171128 0.672351 -0.676458
H -4.716614 2.580759 -1.486481
H 2.629519 3.161753 1.888008
H -4.228331 -2.503969 2.148898
H -4.061901 -3.316648 0.568179
H -5.579286 -3.502134 1.511518


