%chk=000099887.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099887

0 1
 O   0.5298000       2.460600      2.2000000E-02
 O    3.235800       2.339800     -0.8192000    
 O   -6.023300     -9.5200002E-02  0.2930000    
 O   -5.244600      -1.912300     -0.6613000    
 N   -5.066400     -0.7965000     -0.1156000    
 C   0.2534000       1.147200      0.5251000    
 C    1.065700       1.362300     -0.6848000    
 C   -1.127300      0.6428000      0.3588000    
 C    2.586000       1.301800     -0.5820000    
 C   -2.216700       1.401300      0.8038000    
 C   -1.359700     -0.5989000     -0.2456000    
 C    3.247100      5.9700001E-02 -0.2152000    
 C   -3.518600      0.9256000      0.6470000    
 C   -2.661500      -1.074600     -0.4025000    
 C   -3.741100     -0.3123000      4.3699998E-02
 C    2.667500      -1.164100     -0.5499000    
 C    4.461300      9.1799997E-02  0.4710000    
 C    3.301700      -2.355700     -0.1984000    
 C    5.095500      -1.099800      0.8224000    
 C    4.515600      -2.323500      0.4877000    
 H   0.7658000      0.8705000       1.441100    
 H   0.6620000       1.167500      -1.670600    
 H   -2.057800       2.366700       1.277800    
 H  -0.5327000      -1.209800     -0.5943000    
 H   -4.335100       1.546300       1.007300    
 H   -2.796800      -2.043900     -0.8756000    
 H    1.737200      -1.217700      -1.106100    
 H    4.926100       1.035800      0.7438000    
 H    2.853300      -3.308700     -0.4640000    
 H    6.040400      -1.075100       1.357200    
 H    5.010100      -3.251300      0.7603000    


%chk=000099887-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099887

0 1
O 0.575430 1.707098 -0.388899
O 2.468755 0.796140 1.972274
O -6.117260 -0.559739 -1.128306
O -6.342068 -0.769345 1.132321
N -5.652508 -0.494450 0.075195
C -0.138766 1.089604 0.791907
C 0.984518 0.338568 0.126642
C -1.564920 0.695821 0.591031
C 2.338568 0.284518 0.820201
C -2.125773 0.615740 -0.710645
C -2.370170 0.396771 1.721516
C 3.476266 -0.372070 0.112534
C -3.465837 0.226929 -0.887477
C -3.711312 0.001592 1.561409
C -4.239180 -0.080936 0.254108
C 3.413309 -0.721574 -1.264998
C 4.670603 -0.627134 0.842912
C 4.524853 -1.317256 -1.896886
C 5.774490 -1.230286 0.212310
C 5.703502 -1.578127 -1.159690
H 0.124799 1.563560 1.746434
H 0.721979 -0.478678 -0.556924
H -1.507338 0.891961 -1.570831
H -1.943469 0.471513 2.727942
H -3.923598 0.162712 -1.877995
H -4.350140 -0.236765 2.415656
H 2.515363 -0.505368 -1.853321
H 4.704152 -0.339847 1.899080
H 4.475859 -1.575203 -2.960015
H 6.689131 -1.429215 0.780745
H 6.563461 -2.046233 -1.651333


