%chk=000139160.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139160

0 1
 O   -2.277800     -0.4459000      9.3699999E-02
 O   -1.444800      -2.328300     -0.9370000    
 O   0.4408000       3.488600     -0.2120000    
 O    3.436500      -2.850800      0.2415000    
 O    2.609400       3.318200      8.3600000E-02
 O    4.669400      -1.041000      0.3947000    
 N    1.477800       2.797300     -6.6299997E-02
 N    3.556700      -1.601900      0.2485000    
 C   -4.592900      4.2800002E-02  0.5930000    
 C   -3.601300     -0.9538000     -1.3500000E-02
 C   -4.552100       1.385600     -0.1396000    
 C   -6.007600     -0.5319000      0.5691000    
 C   3.7599999E-02 -0.5974000     -0.2359000    
 C   -1.290800      -1.237400     -0.4100000    
 C    1.149300      -1.399700     -7.9000004E-02
 C   0.1194000      0.7801000     -0.2353000    
 C    1.367200       1.381500     -7.0699997E-02
 C    2.397100     -0.7983000      8.5500002E-02
 C    2.506000      0.5922000      8.9800000E-02
 H   -4.305600      0.2296000       1.635700    
 H   -3.661600      -1.907800      0.5245000    
 H   -3.839500      -1.130600      -1.069800    
 H   -5.267600       2.088700      0.3000000    
 H   -4.802100       1.266900      -1.199300    
 H   -3.559000       1.842100     -7.4699998E-02
 H   -6.717700      0.1629000       1.030000    
 H   -6.054100      -1.474000       1.125400    
 H   -6.341100     -0.7266000     -0.4559000    
 H    1.039300      -2.480900     -8.1500001E-02
 H  -0.7714000       1.385900     -0.3767000    
 H    3.478900       1.061100      0.2181000    


%chk=000139160-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139160

0 1
O -2.324196 -0.393834 0.253329
O -1.443134 -2.511279 -0.181567
O 0.500118 3.497642 0.777896
O 3.510905 -2.832887 -0.676429
O 2.766263 3.336391 0.559042
O 4.817532 -0.978688 -0.420656
N 1.581573 2.831341 0.561716
N 3.676917 -1.576974 -0.446149
C -4.697006 0.196827 0.398074
C -3.709073 -0.969021 0.269833
C -4.629449 1.137160 -0.826392
C -6.121875 -0.377259 0.592280
C 0.045085 -0.594494 0.038520
C -1.288840 -1.283303 0.019993
C 1.197335 -1.378173 -0.204319
C 0.165881 0.791668 0.290940
C 1.450642 1.368994 0.295261
C 2.458475 -0.753655 -0.189918
C 2.619774 0.622598 0.057863
H -4.422704 0.773096 1.304462
H -3.769840 -1.668439 1.123988
H -3.856503 -1.540470 -0.665738
H -5.316376 1.992658 -0.697069
H -4.926383 0.601749 -1.748855
H -3.610225 1.535416 -0.972139
H -6.853393 0.443389 0.696924
H -6.191429 -1.010631 1.496103
H -6.426460 -0.987734 -0.279253
H 1.103481 -2.450712 -0.398847
H -0.716610 1.406330 0.481280
H 3.607914 1.089492 0.065726


