%chk=000126724.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126724

0 1
 O   -2.044700       1.176000      -2.100600    
 O    2.844800       1.577700      0.1877000    
 O    3.333900      -1.145100     -6.2100001E-02
 N   -3.075900     -0.2475000      0.1603000    
 C   -2.023400      0.7998000      0.2584000    
 C  -0.5890000      0.2711000      0.1748000    
 C   -2.678900      -1.500500      0.8134000    
 C   -1.463500      -2.088000      0.1035000    
 C  -0.3267000      -1.107800      9.9299997E-02
 C   -2.262300       1.825100     -0.8668000    
 C   0.5008000       1.157700      0.2261000    
 C   -4.350000      0.2083000      0.7295000    
 C   0.9935000      -1.571100      2.0000001E-03
 C    1.813200      0.6889000      0.1458000    
 C    2.059000     -0.6746000      2.4100000E-02
 C    3.375200       1.894800       1.473100    
 C    3.894200      -1.264900      -1.368500    
 H   -2.107500       1.301100       1.232700    
 H   -3.491100      -2.235500      0.7506000    
 H   -2.465600      -1.338300       1.878900    
 H   -1.711700      -2.350500     -0.9324000    
 H   -1.166100      -3.008200      0.6203000    
 H   -1.573800       2.673200     -0.8031000    
 H   -3.271400       2.246800     -0.8590000    
 H   0.3306000       2.226600      0.3324000    
 H   -5.119100     -0.5639000      0.6120000    
 H   -4.733100       1.092900      0.2131000    
 H   -4.262400      0.4429000       1.796600    
 H    1.189300      -2.638000     -7.8699999E-02
 H   -2.676800      0.4393000      -2.161800    
 H    4.192400       2.608800       1.339900    
 H    3.770500      0.9972000       1.959100    
 H    2.606700       2.355500       2.102000    
 H    3.933000     -0.2886000      -1.862000    
 H    3.312100      -1.968600      -1.972000    
 H    4.913600      -1.647900      -1.270200    


%chk=000126724-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126724

0 1
O -2.719661 0.673108 -2.237400
O 2.806033 1.662082 0.263823
O 3.332310 -1.212525 -0.003798
N -3.148736 -0.191918 0.248576
C -2.073165 0.847043 0.139504
C -0.658982 0.266787 0.149476
C -2.746241 -1.486647 0.852909
C -1.574747 -2.092294 0.063499
C -0.403267 -1.126212 0.065923
C -2.360406 1.625034 -1.198633
C 0.432600 1.164215 0.232468
C -4.395988 0.348637 0.833106
C 0.933378 -1.585218 0.009593
C 1.762871 0.706606 0.196020
C 2.017865 -0.688002 0.046362
C 3.687829 1.525598 1.446531
C 4.116461 -0.779567 -1.184783
H -2.145922 1.580607 0.977744
H -3.625588 -2.156639 0.813171
H -2.458257 -1.372862 1.926470
H -1.909864 -2.295724 -0.972939
H -1.278984 -3.059608 0.509971
H -1.461034 2.171037 -1.528858
H -3.180322 2.359532 -1.031217
H 0.270694 2.243627 0.335918
H -5.204162 -0.397922 0.738836
H -4.706854 1.255149 0.286146
H -4.286221 0.612980 1.911605
H 1.154075 -2.655276 -0.072957
H -3.172340 -0.059364 -1.707429
H 4.456656 2.304807 1.330509
H 4.151790 0.523335 1.481240
H 3.109340 1.702228 2.373537
H 4.200296 0.321647 -1.221375
H 3.639647 -1.149254 -2.112308
H 5.108697 -1.240325 -1.062841


