%chk=000097239.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097239

0 1
 O    1.687200       2.357800      0.3508000    
 O    1.407600      -2.720200     -8.9599997E-02
 O   -4.023500     -0.2007000     -9.1200002E-02
 O   -2.790400      -2.013900     -0.1956000    
 N    1.926600     -0.4310000      0.1260000    
 N   -2.904600     -0.7684000     -9.4999999E-02
 C   0.6765000      0.1926000      0.1279000    
 C   0.5738000       1.579100      0.2403000    
 C  -0.4759000     -0.5854000      1.6400000E-02
 C   -1.731000      2.3200000E-02  1.7500000E-02
 C  -0.6813000       2.187600      0.2413000    
 C   -1.833800       1.409700      0.1300000    
 C    2.209100      -1.798400      2.2900000E-02
 C    3.692900      -2.065700      6.0199998E-02
 C    2.267000       2.833900     -0.8617000    
 H  -0.4413000      -1.660500     -7.2099999E-02
 H  -0.7688000       3.267200      0.3295000    
 H   -2.794500       1.918200      0.1347000    
 H    2.723200      0.1962000      0.2156000    
 H    4.180300      -1.564400     -0.7808000    
 H    3.877900      -3.141100     -1.1500000E-02
 H    4.112800      -1.695500      0.9997000    
 H    1.569700       3.497700      -1.382700    
 H    2.548800       2.001000      -1.513500    
 H    3.167600       3.401000     -0.6109000    


%chk=000097239-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097239

0 1
O 1.966537 1.949250 -0.375075
O 1.410724 -2.899602 0.322271
O -4.093637 -0.030109 0.031104
O -2.967670 -1.996186 0.296164
N 1.986300 -0.649619 -0.001911
N -2.999985 -0.719171 0.110383
C 0.710370 -0.045961 -0.062716
C 0.693454 1.375231 -0.266527
C -0.513276 -0.736332 0.061469
C -1.715095 0.003472 -0.020347
C -0.521369 2.086460 -0.344650
C -1.743986 1.398046 -0.220719
C 2.291207 -2.004745 0.180474
C 3.789726 -2.298987 0.189147
C 2.060650 3.398952 -0.585576
H -0.526897 -1.816125 0.216966
H -0.525302 3.168267 -0.500781
H -2.704412 1.915310 -0.276289
H 2.765475 0.007338 -0.108430
H 4.256456 -2.021637 -0.774164
H 3.934761 -3.375694 0.355859
H 4.304324 -1.740592 0.992875
H 1.607157 3.948603 0.259995
H 1.572871 3.690669 -1.534133
H 3.137515 3.613161 -0.637190


