%chk=000090410.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090410

0 1
 O   0.3258000      -1.823700      0.9751000    
 N   -3.130300      0.3204000     -0.6876000    
 C   -2.104700     -0.6800000     -0.3349000    
 C  -0.8479000      0.1097000      0.1004000    
 C   -1.848400      -1.544400      -1.577800    
 C   -2.679800      -1.527600      0.8076000    
 C   -3.423500       1.163500      0.4550000    
 C   0.3895000     -0.7065000      0.4699000    
 C    1.736700     -0.1200000      0.1983000    
 C   -4.465900       2.201000      8.4700003E-02
 C    1.878200       1.247400      0.2374000    
 C    2.780600     -0.9713000     -7.9200000E-02
 C    3.135800       1.795200     -1.5900001E-02
 C    4.038300     -0.4235000     -0.3323000    
 C    4.215700      0.9597000     -0.3006000    
 H   -1.014200      0.6878000       1.015000    
 H  -0.5787000      0.8015000     -0.7081000    
 H   -2.805600      0.8921000      -1.467200    
 H   -2.768600      -2.033900      -1.918300    
 H   -1.116400      -2.332600      -1.371300    
 H   -1.461900     -0.9437000      -2.409400    
 H   -2.132500      -2.472900      0.9007000    
 H   -2.613000      -1.039200       1.785700    
 H   -3.725700      -1.804300      0.6250000    
 H   -3.837200      0.6086000       1.301700    
 H   -2.573400       1.752700      0.8040000    
 H   -4.112600       2.851500     -0.7229000    
 H   -5.398600       1.727600     -0.2411000    
 H   -4.696600       2.834600      0.9477000    
 H    1.060900       1.919300      0.4773000    
 H    2.655400      -2.049100     -0.1127000    
 H    3.275600       2.871900      1.3500000E-02
 H    4.879200      -1.073800     -0.5552000    
 H    5.195200       1.386000     -0.4969000    


%chk=000090410-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090410

0 1
O 0.414107 -2.129533 -0.007519
N -3.244746 0.354390 -0.504711
C -2.171033 -0.676181 -0.342250
C -0.771384 0.017206 -0.191606
C -2.205691 -1.540994 -1.625616
C -2.490375 -1.553858 0.892357
C -3.485506 1.342429 0.566423
C 0.475903 -0.865191 -0.070890
C 1.822364 -0.183040 -0.024265
C -4.665025 2.257414 0.187456
C 1.974601 1.229886 -0.063482
C 2.984010 -0.997768 0.071223
C 3.259220 1.812356 -0.008658
C 4.265889 -0.416711 0.125066
C 4.407416 0.991834 0.085198
H -0.793892 0.679048 0.700162
H -0.623433 0.694360 -1.060395
H -3.186933 0.806486 -1.429093
H -3.210058 -1.983900 -1.741599
H -1.456768 -2.346449 -1.570919
H -1.995390 -0.926958 -2.524618
H -1.793971 -2.406197 0.937031
H -2.396586 -0.987463 1.837908
H -3.526410 -1.927799 0.814575
H -3.733914 0.798610 1.496454
H -2.596243 1.982538 0.800118
H -4.446424 2.830124 -0.734982
H -5.572181 1.654655 0.007294
H -4.874695 2.984792 0.992574
H 1.096796 1.880271 -0.134219
H 2.847299 -2.083901 0.101647
H 3.366811 2.902223 -0.038373
H 5.153711 -1.054379 0.197818
H 5.403930 1.445704 0.127491


