%chk=000140953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000140953

0 1
 O    6.552500       1.182700     -0.2124000    
 O    6.552400      -1.182900     -0.2056000    
 O   -6.464300       1.097300      0.2047000    
 O   -6.464200      -1.097900      0.2025000    
 N   0.2746000     -9.9999997E-05  0.5582000    
 N    5.831400       0.000000     -0.1248000    
 N  -0.2948000      6.0000003E-04 -0.5585000    
 N   -5.860700     -1.9999999E-04  0.1291000    
 C    1.662600     -1.9999999E-04  0.3875000    
 C    4.431500       0.000000      4.6999998E-02
 C   -1.689600      3.0000001E-04 -0.3864000    
 C    2.355000       1.207900      0.3031000    
 C    2.354800      -1.208200      0.3019000    
 C    3.739400       1.208000      0.1326000    
 C    3.739300      -1.208000      0.1317000    
 C   -4.451500       0.000000     -4.5299999E-02
 C   -2.375100       1.208300     -0.3010000    
 C   -2.374800      -1.207700     -0.3026000    
 C   -3.759400       1.208100     -0.1299000    
 C   -3.759200      -1.207900     -0.1317000    
 H    1.824300       2.154200      0.3696000    
 H    1.824200      -2.154500      0.3674000    
 H    4.253800       2.163100      6.9799997E-02
 H    4.253600      -2.163100      6.8000004E-02
 H   -1.843200       2.153800     -0.3668000    
 H   -1.842900      -2.153000     -0.3696000    
 H   -4.265500       2.168000     -6.6799998E-02
 H   -4.265100      -2.168000     -7.0100002E-02
 H    6.875200       1.147300      -1.128800    
 H    6.878100      -1.151100      -1.121000    


%chk=000140953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000140953

0 1
O 6.459508 1.261124 -0.095786
O 6.631334 -1.080580 0.470049
O -6.766111 1.072746 -0.121501
O -6.570883 -1.114817 0.500201
N 0.339228 -0.514500 0.035803
N 5.985128 -0.105505 -0.447942
N -0.391589 0.543962 -0.233326
N -6.063666 0.022338 0.151798
C 1.742279 -0.314999 -0.075425
C 4.560234 -0.156950 -0.229338
C -1.800608 0.322979 -0.110888
C 2.372637 0.915903 -0.428974
C 2.544614 -1.455080 0.205320
C 3.768129 0.994731 -0.506019
C 3.944840 -1.384704 0.130123
C -4.589570 0.127655 0.060178
C -2.615002 1.451411 -0.402819
C -2.404576 -0.912193 0.270499
C -4.014979 1.361722 -0.319376
C -3.800469 -1.011344 0.356520
H 1.745713 1.789313 -0.630298
H 2.041446 -2.385671 0.486369
H 4.265316 1.933968 -0.756835
H 4.566522 -2.251260 0.361376
H -2.121550 2.384204 -0.691969
H -1.758233 -1.766233 0.490496
H -4.664447 2.212843 -0.538001
H -4.297258 -1.941265 0.645631
H 7.189495 1.420045 -0.754381
H 7.394918 -1.423043 -0.069683


