%chk=000115007.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115007

0 1
 O   -4.482000       1.678900     -0.2693000    
 N    2.691800      0.1687000      0.6194000    
 C    1.378000     -0.2946000      0.1772000    
 C   0.9792000      -1.557300      0.9416000    
 C   0.3378000      0.8082000      0.4086000    
 C  -0.3484000      -2.100500      0.4133000    
 C   -1.083800      0.3349000      0.2135000    
 C   -1.413900      -1.043200      0.2571000    
 C    3.091600       1.360800     -0.1274000    
 C    3.687100     -0.8912000      0.4616000    
 C   -2.750400      -1.451600      0.1022000    
 C   -2.096700       1.294100      4.8799999E-02
 C   -3.724800     -0.4884000     -7.8800000E-02
 C   -3.397300      0.8559000     -0.1032000    
 C   -5.191200     -0.6398000     -0.1964000    
 C    4.448300       1.861800      0.3611000    
 C    3.762600      -1.334100     -0.9975000    
 C   -5.542100      0.7744000     -0.6608000    
 C    4.877600       3.115100     -0.3859000    
 C    4.776700      -2.452100      -1.185100    
 H    1.351300     -0.5014000     -0.9001000    
 H   0.8889000      -1.338900       2.014200    
 H    1.681400      -2.387800      0.8368000    
 H   0.4893000       1.631800     -0.2990000    
 H   0.4181000       1.209800       1.427600    
 H  -0.7021000      -2.884900       1.093600    
 H  -0.1857000      -2.563200     -0.5686000    
 H    3.081400       1.230200      -1.215200    
 H    2.404000       2.186900      8.3700001E-02
 H    4.675100     -0.5933000      0.8244000    
 H    3.483500      -1.742000       1.119200    
 H   -3.016800      -2.503900      0.1303000    
 H   -1.866300       2.354700      3.7400000E-02
 H   -5.502800      -1.395800     -0.9215000    
 H   -5.630400     -0.8540000      0.7833000    
 H    4.417100       2.072700       1.436900    
 H    5.251900       1.142400      0.1841000    
 H    2.818400      -1.737400      -1.372100    
 H    4.068300     -0.5220000      -1.663300    
 H   -5.633000      0.8201000      -1.753700    
 H   -6.488200       1.117100     -0.2291000    
 H    4.962200       2.923200      -1.460500    
 H    4.158100       3.926700     -0.2373000    
 H    5.852400       3.457900     -2.4700001E-02
 H    5.778400      -2.126800     -0.8864000    
 H    4.508000      -3.330000     -0.5887000    
 H    4.819000      -2.756300      -2.235900    


%chk=000115007-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115007

0 1
O -4.619769 1.791073 0.094259
N 2.699152 0.129510 0.371192
C 1.350882 -0.325010 -0.107152
C 0.904776 -1.657213 0.541052
C 0.291134 0.761795 0.223437
C -0.440693 -2.127583 -0.050230
C -1.164954 0.314558 0.109485
C -1.522980 -1.058678 0.009914
C 3.169707 1.345953 -0.350826
C 3.738133 -0.929686 0.471196
C -2.895078 -1.430047 -0.052444
C -2.176936 1.314144 0.132848
C -3.894444 -0.447326 -0.026261
C -3.517086 0.912402 0.064324
C -5.416110 -0.536381 -0.015612
C 4.474322 1.955130 0.206154
C 4.195685 -1.609321 -0.852712
C -5.833361 0.953699 -0.206799
C 4.747715 3.351792 -0.394845
C 5.276454 -2.680621 -0.591177
H 1.356101 -0.482412 -1.218872
H 0.817646 -1.511245 1.636072
H 1.651819 -2.452247 0.368515
H 0.426874 1.646816 -0.425151
H 0.496032 1.098713 1.260939
H -0.780738 -3.038133 0.480042
H -0.276982 -2.430345 -1.106880
H 3.296545 1.157372 -1.449563
H 2.386353 2.119107 -0.258913
H 4.623111 -0.484028 0.961806
H 3.381377 -1.708326 1.169287
H -3.161032 -2.492820 -0.116310
H -1.916419 2.375300 0.203873
H -5.820443 -1.175854 -0.819843
H -5.780833 -0.939241 0.948676
H 4.388003 2.026305 1.307964
H 5.338346 1.297374 -0.009627
H 3.325828 -2.074992 -1.357813
H 4.592030 -0.844952 -1.549907
H -6.123956 1.167696 -1.251855
H -6.628104 1.288679 0.477662
H 4.811955 3.306334 -1.498893
H 3.941548 4.063219 -0.134317
H 5.699907 3.768752 -0.019662
H 6.170341 -2.235351 -0.114164
H 4.897152 -3.470676 0.084891
H 5.602588 -3.167434 -1.528363


