%chk=000163440.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163440

0 1
 O   -2.834500     -0.4506000      -2.685900    
 O  -0.8376000      0.3034000      -2.172800    
 N  -5.1600002E-02  0.5454000      0.1754000    
 N   -1.963100     -0.1372000      -1.841400    
 C    2.262300       1.358100      0.4617000    
 C    2.925900      0.2425000     -0.3814000    
 C   0.9574000      0.9077000       1.142200    
 C    2.082400       2.612800     -0.4248000    
 C    3.244700      -1.064700      0.3537000    
 C    3.973500      -2.090800     -0.5140000    
 C    1.525300       3.819300      0.3175000    
 C   -1.303100      5.7100002E-02  0.5157000    
 C    4.176100      -3.402000      0.2303000    
 C   -2.262400     -0.2861000     -0.4581000    
 C   -1.646500     -0.1086000       1.871400    
 C   -3.515300     -0.7760000     -8.9199997E-02
 C   -2.899600     -0.5984000       2.240000    
 C   -3.833900     -0.9320000       1.259800    
 H    2.966600       1.619700       1.263500    
 H    3.866400      0.6362000     -0.7900000    
 H    2.297100      1.1000000E-02  -1.250500    
 H   0.5885000       1.714100       1.786600    
 H    1.176600      5.9999999E-02   1.801200    
 H    1.440500       2.394500      -1.286000    
 H    3.060400       2.894000     -0.8360000    
 H    3.851300     -0.8412000       1.239800    
 H    2.312000      -1.516300      0.7100000    
 H    4.946500      -1.691800     -0.8223000    
 H    3.396600      -2.282300      -1.426100    
 H   0.1778000      0.6507000     -0.8024000    
 H   0.4828000       3.665400      0.6105000    
 H    2.113200       4.035900       1.214900    
 H    1.556400       4.702800     -0.3286000    
 H    3.216400      -3.843100      0.5179000    
 H    4.703000      -4.120500     -0.4054000    
 H    4.770700      -3.250300       1.136800    
 H  -0.9556000      0.1387000       2.672800    
 H   -4.271100      -1.047600     -0.8218000    
 H   -3.148500     -0.7196000       3.290200    
 H   -4.809500      -1.313200       1.547400    


%chk=000163440-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000163440

0 1
O -2.959398 -0.526883 -2.739305
O -0.849618 0.203651 -2.283899
N -0.072755 0.500806 0.197637
N -2.041347 -0.203064 -1.887631
C 2.265853 1.327875 0.440916
C 2.904321 0.203621 -0.423210
C 0.970513 0.873531 1.160939
C 2.064475 2.617182 -0.405944
C 3.250268 -1.096345 0.337590
C 4.054160 -2.096814 -0.524978
C 1.575495 3.845404 0.391956
C -1.328983 0.068031 0.531734
C 4.382454 -3.406787 0.223081
C -2.320638 -0.286605 -0.464721
C -1.730501 -0.056993 1.907137
C -3.616627 -0.733262 -0.088893
C -3.010275 -0.498438 2.256687
C -3.968910 -0.842153 1.260062
H 2.982653 1.571730 1.254936
H 3.833802 0.612085 -0.870607
H 2.241759 -0.040252 -1.279828
H 0.606908 1.692430 1.815254
H 1.198893 0.013728 1.824230
H 1.361007 2.415624 -1.239636
H 3.035138 2.859177 -0.883137
H 3.834891 -0.849290 1.249432
H 2.321797 -1.594800 0.682536
H 4.994683 -1.614696 -0.861481
H 3.477605 -2.328410 -1.443486
H 0.106436 0.548098 -0.818571
H 0.552719 3.701737 0.785790
H 2.244010 4.058010 1.248075
H 1.554680 4.744910 -0.249667
H 3.457459 -3.922508 0.543368
H 4.953495 -4.105107 -0.415775
H 4.986049 -3.207133 1.128875
H -1.013567 0.199761 2.691217
H -4.317415 -0.984534 -0.889400
H -3.276170 -0.579874 3.316684
H -4.967220 -1.186445 1.544630


