%chk=000151328.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151328

0 1
 O   0.1805000      -2.781400     -7.8699999E-02
 O    2.787600      -3.230500     -6.2399998E-02
 O   -4.366700      -1.466000      1.5900001E-02
 O   -5.001300      0.8549000      0.1069000    
 N    1.946100       3.111400      1.7000001E-02
 C    1.416400      0.7223000      2.6000000E-03
 C   0.9986000       2.077500      2.8700000E-02
 C    2.798600      0.4132000      9.8999999E-03
 C    3.811000       1.525800      0.1030000    
 C   0.4637000     -0.3384000     -1.4600000E-02
 C    3.260400       2.791900     -0.5338000    
 C  -0.9384000     -3.5399999E-02  1.0200000E-02
 C   -1.343800       1.329000      6.2799998E-02
 C  -0.3796000       2.342400      7.6200001E-02
 C   0.9665000      -1.663500     -4.5800000E-02
 C    3.247500     -0.9103000     -2.0000001E-03
 C    2.331800      -1.946100     -4.0300000E-02
 C   -1.965200      -1.018100     -7.4999998E-03
 C    1.556300       4.511600      8.4500000E-02
 C   -2.706200       1.683100      9.7800002E-02
 C   -3.291200     -0.6324000      2.6900001E-02
 C   -3.652600      0.6847000      7.9000004E-02
 C   -5.449800     -0.5151000      6.6699997E-02
 C   0.3363000      -3.644600      -1.200600    
 C    2.993600      -3.866000       1.197300    
 H    4.039100       1.699500       1.162000    
 H    4.742400       1.245900     -0.4028000    
 H    3.967800       3.610800     -0.3571000    
 H    3.176600       2.671800      -1.622200    
 H  -0.7281000       3.374200      0.1055000    
 H    4.312700      -1.126800      1.8200001E-02
 H   -1.803700      -2.083200     -3.9999999E-02
 H    1.023100       4.812800     -0.8235000    
 H    2.433600       5.160100      0.1844000    
 H   0.9264000       4.705700      0.9594000    
 H   -3.018700       2.723200      0.1378000    
 H   -6.050900     -0.7146000      0.9614000    
 H   -6.080200     -0.6527000     -0.8194000    
 H  -0.6635000      -3.926800      -1.545400    
 H   0.8496000      -4.562600     -0.9003000    
 H   0.8547000      -3.170200      -2.041700    
 H    3.321900      -4.892600       1.013000    
 H    2.064300      -3.894800       1.774900    
 H    3.772000      -3.346300       1.764700    


%chk=000151328-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151328

0 1
O 0.258287 -2.838671 -0.134340
O 3.032849 -3.233675 0.082835
O -4.380569 -1.544392 0.146281
O -5.042040 0.756188 0.027696
N 1.986032 3.162644 -0.028142
C 1.509510 0.729662 0.053604
C 1.042765 2.118084 -0.014406
C 2.916148 0.467147 0.153892
C 3.884981 1.631261 0.274016
C 0.551950 -0.362285 0.025970
C 3.357516 2.857250 -0.483064
C -0.887694 -0.070033 0.028169
C -1.300185 1.318883 -0.018961
C -0.328180 2.372093 -0.064333
C 1.096748 -1.698005 0.000803
C 3.390157 -0.847571 0.194141
C 2.485117 -1.930051 0.119252
C -1.901837 -1.091754 0.111158
C 1.521905 4.546304 -0.161637
C -2.695967 1.675268 -0.022219
C -3.229236 -0.702949 0.116328
C -3.627531 0.656071 0.043574
C -5.522217 -0.619830 0.331302
C 0.327775 -3.460687 -1.478807
C 2.623166 -4.128826 1.189848
H 4.007650 1.903044 1.341873
H 4.880870 1.345745 -0.110744
H 3.995295 3.736318 -0.281324
H 3.383045 2.664149 -1.580365
H -0.702033 3.396231 -0.142769
H 4.459330 -1.067032 0.279293
H -1.613992 -2.138865 0.181022
H 1.024830 4.748061 -1.137329
H 2.384534 5.226615 -0.066069
H 0.805130 4.793405 0.642971
H -2.997369 2.725180 -0.067082
H -5.854999 -0.654724 1.386908
H -6.319160 -0.883749 -0.380434
H -0.354001 -4.324507 -1.441420
H 1.359578 -3.792729 -1.691937
H -0.012699 -2.743089 -2.248553
H 3.129505 -5.085960 0.991184
H 1.527571 -4.261228 1.202907
H 2.966664 -3.715591 2.157511


