%chk=000133298.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133298

0 1
 O    1.020300       1.904900       1.829700    
 O   -3.601300     -0.8381000      -1.096800    
 N   0.8301000      -1.832200     -0.7058000    
 N  -0.5060000       3.768800      0.3253000    
 N   -3.679100      -1.418700      0.1633000    
 C   0.6905000      0.1837000      0.2126000    
 C   0.1551000       1.441500      0.7782000    
 C  -4.5200001E-02 -0.8700000     -0.2790000    
 C    2.067300     -0.1501000      7.9700001E-02
 C    2.127200      -1.419700     -0.4991000    
 C   1.6899999E-02   2.561500     -0.2739000    
 C   -1.511800     -0.9781000     -0.3512000    
 C   -2.414800      -1.491900      0.5889000    
 C    3.272200      0.5079000      0.3973000    
 C   -2.301500     -0.5800000      -1.391700    
 C    3.336500      -2.066700     -0.7772000    
 C   -2.129100      -2.065900       1.914900    
 C    4.489300     -0.1271000      0.1247000    
 C    4.518600      -1.394600     -0.4535000    
 C   -1.841600       3.541500      0.8914000    
 C  -0.5600000       4.863000     -0.6524000    
 C   -2.044700      4.0399998E-02  -2.699000    
 C   -1.889200      -3.580100       1.873300    
 H  -0.8079000       1.217300       1.246900    
 H  -0.6077000       2.222100      -1.110000    
 H    1.013600       2.772400     -0.6844000    
 H   0.5658000      -2.718500      -1.113800    
 H    3.283500       1.500800      0.8360000    
 H    3.360300      -3.053400      -1.227400    
 H   -1.249000      -1.581000       2.354200    
 H   -2.960500      -1.860700       2.600900    
 H    1.005900       1.235600       2.535600    
 H    5.422000      0.3768000      0.3645000    
 H    5.475200      -1.869000     -0.6574000    
 H   -1.802300       2.942100       1.805700    
 H   -2.522700       3.067200      0.1753000    
 H   -2.292100       4.493000       1.199400    
 H  -0.8971000       5.790000     -0.1754000    
 H   -1.233500       4.636000      -1.486900    
 H   0.4377000       5.065000      -1.057800    
 H   -2.519200     -0.5370000      -3.498700    
 H   -2.449000       1.057100      -2.724200    
 H  -0.9739000      9.6500002E-02  -2.916700    
 H   -2.766200      -4.106100       1.481400    
 H   -1.684000      -3.957600       2.879900    
 H   -1.034300      -3.825600       1.234300    


%chk=000133298-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133298

0 1
O 0.913945 1.805296 2.098262
O -3.822448 -0.931783 -0.930545
N 0.649880 -1.863571 -0.782268
N -0.740907 3.734966 0.318408
N -3.819669 -1.528877 0.424353
C 0.616103 0.158061 0.285548
C 0.110697 1.438011 0.907364
C -0.185971 -0.871407 -0.224696
C 2.000675 -0.214176 0.036665
C 1.988677 -1.489669 -0.632199
C 0.203806 2.659517 -0.041912
C -1.651177 -1.011302 -0.255518
C -2.515723 -1.554799 0.779808
C 3.249459 0.402898 0.321911
C -2.506037 -0.636881 -1.287143
C 3.174135 -2.151594 -1.023050
C -2.124846 -2.107299 2.127638
C 4.433175 -0.251053 -0.068990
C 4.396996 -1.513711 -0.733668
C -2.102009 3.500833 -0.192443
C -0.243116 5.089682 0.017653
C -2.285031 0.011674 -2.614430
C -1.332027 -3.436276 2.031428
H -0.951641 1.304046 1.202508
H 0.051086 2.307765 -1.094100
H 1.236760 3.044971 0.027616
H 0.309759 -2.721072 -1.213592
H 3.278039 1.362714 0.846138
H 3.151596 -3.122388 -1.530773
H -1.511042 -1.354353 2.658792
H -3.044218 -2.259576 2.720423
H 0.935663 1.026423 2.710872
H 5.403698 0.211119 0.143268
H 5.337425 -1.996676 -1.021875
H -2.475706 2.517426 0.145079
H -2.162223 3.522467 -1.313991
H -2.788534 4.271434 0.201080
H -0.950732 5.840119 0.415134
H -0.112778 5.291433 -1.077055
H 0.729870 5.244575 0.515172
H -2.668640 -0.617813 -3.437120
H -2.806959 0.984217 -2.669326
H -1.207707 0.183850 -2.770207
H -1.922992 -4.208530 1.507927
H -1.095169 -3.812568 3.042482
H -0.379843 -3.295123 1.490470


