%chk=000048127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048127

0 1
 O   -2.246200      -2.928200      0.2869000    
 N   -3.094300      0.3916000     -0.1838000    
 C   -4.307700      0.9235000     -0.8034000    
 C   -2.354700       1.567800      0.2735000    
 C   -4.729400       2.021500      0.1618000    
 C   -3.445200       2.447300      0.8669000    
 C   -2.318100     -0.4316000      -1.099300    
 C   -1.072500     -0.9721000     -0.4488000    
 C   9.8300003E-02 -0.2286000     -0.5217000    
 C   -1.101200      -2.193500      0.2112000    
 C    1.261200     -0.7152000      7.5800002E-02
 C   6.1299998E-02  -2.680100      0.8092000    
 C    1.242500      -1.941000      0.7415000    
 C    2.486400      5.0999999E-02  5.7000001E-03
 C    2.783600      0.9832000      0.9999000    
 C    3.370200     -0.1424000      -1.055900    
 C    3.965100       1.721900      0.9326000    
 C    4.551500      0.5965000      -1.123300    
 C    4.849200       1.528500     -0.1290000    
 H   -5.085300      0.1607000     -0.9105000    
 H   -4.104400       1.357100      -1.790900    
 H   -1.873300       2.101300     -0.5562000    
 H   -1.605400       1.338100       1.037300    
 H   -5.446700       1.638900      0.8974000    
 H   -5.200700       2.858500     -0.3630000    
 H   -3.232100       3.510000      0.7131000    
 H   -3.541300       2.276500       1.945700    
 H   -2.039800      0.1287000      -2.003500    
 H   -2.932300      -1.266200      -1.461400    
 H   0.1162000      0.7215000      -1.050900    
 H   6.1200000E-02  -3.633300       1.331100    
 H    2.139800      -2.334900       1.213100    
 H   -2.067300      -3.744300      0.7848000    
 H    2.105300       1.146600       1.834100    
 H    3.153800     -0.8649000      -1.839300    
 H    4.196700       2.447800       1.706600    
 H    5.239800      0.4461000      -1.949900    
 H    5.769000       2.103700     -0.1815000    


%chk=000048127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048127

0 1
O -2.360994 -2.712352 0.577823
N -3.105255 0.443384 -0.321699
C -4.452311 0.704206 -0.888671
C -2.537239 1.782513 -0.037795
C -5.005326 1.855427 -0.006520
C -3.730321 2.553428 0.583078
C -2.259509 -0.452773 -1.140102
C -1.035632 -0.936841 -0.379380
C 0.210629 -0.287569 -0.500791
C -1.124738 -2.046553 0.503888
C 1.362244 -0.682972 0.235421
C 0.001444 -2.466774 1.249799
C 1.228408 -1.786923 1.118485
C 2.661594 0.031557 0.085815
C 3.562389 0.152000 1.181252
C 3.042028 0.615204 -1.155283
C 4.795010 0.824520 1.041587
C 4.271925 1.292832 -1.295623
C 5.157613 1.400682 -0.198203
H -5.070493 -0.210469 -0.851852
H -4.393134 1.036279 -1.959119
H -2.194860 2.288858 -0.980427
H -1.668226 1.706968 0.637789
H -5.630983 1.452187 0.807719
H -5.628744 2.548825 -0.597958
H -3.685821 3.629282 0.338637
H -3.715754 2.456555 1.681914
H -1.927917 0.052477 -2.085725
H -2.879037 -1.322263 -1.423402
H 0.273984 0.578277 -1.171398
H -0.073235 -3.333856 1.919693
H 2.098269 -2.144535 1.680043
H -2.323364 -3.444047 1.242469
H 3.281562 -0.257570 2.158428
H 2.383779 0.510571 -2.025370
H 5.467351 0.909569 1.902984
H 4.544521 1.726709 -2.264479
H 6.113343 1.925189 -0.307126


