%chk=000041652.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041652

0 1
 O    1.872300     -0.5971000      -1.460300    
 N    1.495900      0.6263000      0.4776000    
 N    3.611600      -2.223200     -9.2699997E-02
 C   0.8303000       1.754000     -0.1346000    
 C  -0.5939000       1.925800      0.4165000    
 C   -1.452800      0.6986000      0.2240000    
 C    1.651800       3.019700      8.9699998E-02
 C   -2.202000      0.5696000     -0.9344000    
 C   -1.475300     -0.2756000       1.209100    
 C    1.964800     -0.4632000     -0.2421000    
 C    2.589600      -1.508700      0.6587000    
 C   -2.995300     -0.5639000      -1.112400    
 C   -2.268500      -1.409100       1.030900    
 C   -3.028400      -1.553200     -0.1300000    
 H   0.7682000       1.580000      -1.215900    
 H   -1.078300       2.787000     -6.2500000E-02
 H  -0.5574000       2.168600       1.487600    
 H    1.181100       3.882700     -0.3923000    
 H    2.659100       2.907100     -0.3263000    
 H    1.759500       3.240600       1.157500    
 H    1.613500      0.6415000       1.486700    
 H   -2.180500       1.333700      -1.706100    
 H  -0.8901000     -0.1731000       2.118300    
 H    1.807800      -2.198300      0.9912000    
 H    3.043400      -1.045300       1.540000    
 H   -3.586400     -0.6764000      -2.016600    
 H   -2.294600      -2.179400       1.796100    
 H   -3.645800      -2.435900     -0.2687000    
 H    4.318500      -1.568700     -0.4257000    
 H    3.198800      -2.649800     -0.9211000    


%chk=000041652-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041652

0 1
O 1.947016 -0.170530 -1.766689
N 1.598791 0.648892 0.389337
N 3.671359 -2.254160 -0.774218
C 0.818383 1.836441 -0.016984
C -0.574653 1.857841 0.666336
C -1.451495 0.625654 0.453579
C 1.600738 3.136153 0.276926
C -1.416846 -0.131383 -0.746866
C -2.371618 0.243800 1.464161
C 2.087660 -0.282352 -0.508650
C 2.790396 -1.510619 0.131332
C -2.285830 -1.230945 -0.930070
C -3.242472 -0.854188 1.283645
C -3.203956 -1.596712 0.081049
H 0.700246 1.735866 -1.110889
H -1.106539 2.755398 0.287484
H -0.439591 2.028162 1.754857
H 1.037654 4.019202 -0.077194
H 2.578522 3.121656 -0.234203
H 1.777188 3.260819 1.362878
H 1.740747 0.490188 1.390079
H -0.703655 0.120828 -1.539859
H -2.408255 0.814623 2.401291
H 1.994532 -2.191961 0.492812
H 3.364924 -1.195736 1.024104
H -2.240905 -1.804175 -1.863105
H -3.945826 -1.129913 2.077810
H -3.876020 -2.449945 -0.064230
H 4.503844 -1.717097 -1.044419
H 3.172557 -2.561507 -1.618103


