%chk=000092315.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092315

0 1
 O    2.159200      0.2105000      1.1100000E-02
 O   -2.608800      -1.643500      2.9800000E-02
 O    5.546000       1.081500     -1.0300000E-02
 O    3.724900       2.306900      2.0500001E-02
 N   -2.907800      0.6549000     -6.8000001E-03
 N    4.282700       1.169900      2.7000001E-03
 C   -4.374000      0.6187000     -7.1999999E-03
 C   -4.898200       2.058400     -3.0400001E-02
 C   -4.843300     -0.1319000      -1.257900    
 C   -4.865500     -0.1007000       1.254500    
 C   -2.169600     -0.4981000      1.1900000E-02
 C  -0.7111000     -0.1933000      9.6000005E-03
 C   0.1808000      -1.194900      1.3300000E-02
 C    1.643100      -1.013400      1.6000000E-03
 C    2.546100      -2.003500     -1.7800000E-02
 C    3.503300      1.1600000E-02 -3.3000000E-03
 C    3.792400      -1.333000     -2.1400001E-02
 H   -4.544500       2.594400     -0.9188000    
 H   -5.993500       2.084000     -3.6400001E-02
 H   -4.553500       2.618800      0.8466000    
 H   -4.592100      -1.196400      -1.245600    
 H   -4.404700      0.2991000      -2.165600    
 H   -5.933500     -7.0000000E-02  -1.357500    
 H   -4.441000      0.3540000       2.157300    
 H   -5.957200     -3.7200000E-02   1.334100    
 H   -4.611800      -1.164500       1.272900    
 H   -2.448600       1.561400     -2.0800000E-02
 H  -0.3953000      0.8449000      5.0000002E-04
 H  -0.1617000      -2.227200      1.9600000E-02
 H    2.375900      -3.070800     -2.8500000E-02
 H    4.776300      -1.780800     -3.5500001E-02


%chk=000092315-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000092315

0 1
O 2.189018 0.203792 -0.005937
O -2.608379 -1.709820 0.003565
O 5.680748 1.011598 -0.010492
O 3.823071 2.371809 -0.018016
N -2.961661 0.611808 -0.008367
N 4.396106 1.212607 -0.011484
C -4.460077 0.612669 -0.009403
C -4.897448 2.096766 -0.019427
C -4.980270 -0.109928 -1.280343
C -4.982546 -0.093110 1.270105
C -2.157914 -0.515660 -0.001531
C -0.691713 -0.219637 -0.003186
C 0.209701 -1.248992 0.002135
C 1.640879 -1.102616 0.001158
C 2.689571 -2.037725 0.006065
C 3.576552 0.036013 -0.005123
C 3.922510 -1.312966 0.002108
H -4.527832 2.618649 -0.922502
H -5.998750 2.162028 -0.020615
H -4.529070 2.630375 0.877267
H -4.627884 -1.153924 -1.297891
H -4.625798 0.401354 -2.193599
H -6.085330 -0.108337 -1.285277
H -4.629841 0.430487 2.177048
H -6.087622 -0.091595 1.272979
H -4.630010 -1.136667 1.302288
H -2.500660 1.525055 -0.014010
H -0.345732 0.822213 -0.008806
H -0.187277 -2.272375 0.007541
H 2.566811 -3.118808 0.011859
H 4.935847 -1.705266 0.004093


