%chk=000035118.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035118

0 1
 O   -1.554100      0.3875000     -0.5614000    
 O   -4.235400      0.3741000      0.2377000    
 N    2.119100      -2.362900      0.2374000    
 N    2.665600       2.287100     -3.0900000E-02
 N    2.423300     -4.1299999E-02  0.1088000    
 N   0.5253000       1.368000     -0.3027000    
 N   0.2458000      -1.011200     -0.1657000    
 C   -2.325100     -0.8051000     -0.5939000    
 C   -3.779800     -0.4476000     -0.8303000    
 C    1.569500      -1.075900      5.0999999E-02
 C    1.845800       1.169900     -7.6200001E-02
 C    1.331100      -3.555100      0.2022000    
 C    4.088100       2.228700      0.2008000    
 C  -0.2058000      0.2421000     -0.3339000    
 C   -5.590900      0.7591000      5.6699999E-02
 C    2.213200      -4.770500      0.4138000    
 C    4.680600       3.624400      0.1658000    
 C   -6.016200       1.628600       1.220600    
 H   -2.238100      -1.322500      0.3698000    
 H   -1.978900      -1.460500      -1.401800    
 H   -4.385200      -1.359200     -0.8825000    
 H   -3.875800      0.1067000      -1.771200    
 H   0.8228000      -3.649700     -0.7644000    
 H   0.5646000      -3.529900      0.9854000    
 H    4.571700       1.614900     -0.5677000    
 H    4.293400       1.774800       1.177100    
 H    3.118100      -2.407900      0.4027000    
 H    2.217900       3.186000     -0.1696000    
 H   -5.695900       1.319500     -0.8791000    
 H   -6.226500     -0.1323000      1.0600000E-02
 H    1.614600      -5.686400      0.3873000    
 H    2.722900      -4.723500       1.382100    
 H    2.980300      -4.840900     -0.3648000    
 H    4.508000       4.100800     -0.8052000    
 H    4.232100       4.261700      0.9354000    
 H    5.760200       3.585800      0.3407000    
 H   -5.382600       2.519200       1.288400    
 H   -5.906600       1.087600       2.166300    
 H   -7.057900       1.944000       1.113100    


%chk=000035118-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035118

0 1
O -1.509999 0.445009 -0.755632
O -4.347127 0.200476 0.257633
N 2.124333 -2.360338 0.278437
N 2.706606 2.268760 -0.161808
N 2.483270 -0.062124 0.070825
N 0.572295 1.377008 -0.467072
N 0.256764 -1.028718 -0.244615
C -2.381045 -0.757600 -0.774187
C -3.799570 -0.269781 -1.015603
C 1.604128 -1.118930 0.027657
C 1.908976 1.156830 -0.184617
C 1.333700 -3.600863 0.273533
C 4.148480 2.238153 0.124065
C -0.174987 0.247580 -0.474835
C -5.640195 0.879509 0.097712
C 2.212320 -4.793284 0.687092
C 4.720655 3.665276 0.133752
C -6.100884 1.318300 1.487283
H -2.305579 -1.290934 0.188858
H -2.041304 -1.432658 -1.581113
H -4.417512 -1.109850 -1.408435
H -3.792978 0.544697 -1.772015
H 0.905216 -3.765695 -0.734448
H 0.475946 -3.489055 0.963071
H 4.664149 1.616954 -0.634049
H 4.317518 1.742941 1.099362
H 3.126722 -2.392422 0.469422
H 2.237037 3.154254 -0.356736
H -5.520824 1.756039 -0.577740
H -6.379352 0.187085 -0.367219
H 1.618604 -5.723501 0.678208
H 2.616027 -4.658400 1.707450
H 3.060537 -4.928216 -0.009830
H 4.582808 4.160501 -0.845493
H 4.235934 4.285655 0.910052
H 5.802852 3.638936 0.348635
H -5.356246 1.995610 1.939273
H -6.218748 0.443208 2.149493
H -7.069330 1.847687 1.426033


