%chk=000160393.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160393

0 1
 O   -4.805700      0.6951000     -6.5899998E-02
 O   -1.346700      0.8241000      -2.922900    
 O   -2.152800       2.803200      -1.367400    
 O  -0.3025000      -3.524100      -1.492500    
 O   0.4553000       2.375000     -0.7164000    
 O    1.868000      -2.954300     -0.5012000    
 O    4.116900      -2.296400      0.4701000    
 O    5.805300     -0.3601000       1.294700    
 O    5.056400       2.296600       1.196900    
 N   -5.249800     -0.6055000       2.396100    
 C   -3.618000      0.3262000      0.6435000    
 C   -3.998200      4.0300000E-02   2.077000    
 C   -3.042000     -0.9375000     -1.7899999E-02
 C   -2.562500     -0.6803000      -1.464000    
 C   -5.097100      0.8155000       2.690000    
 C   -1.537000      0.4672000      -1.553700    
 C   -2.621000       1.486800      0.5741000    
 C   -2.122000       1.689200     -0.8428000    
 C   -1.998300      -1.954900      -2.092600    
 C  -0.1689000      6.6699997E-02  -1.033000    
 C   -5.219400      -1.397700       3.614300    
 C   0.2360000      -1.277000      -1.009100    
 C  -0.6629000      -2.350200      -1.508000    
 C   0.7538000       1.042300     -0.6117000    
 C    1.505300      -1.635200     -0.5311000    
 C    2.029800      0.6998000     -0.1312000    
 C    2.408100     -0.6583000     -8.5600004E-02
 C    2.937200       1.680300      0.3041000    
 C    3.682400      -1.001800      0.3965000    
 C    4.198700       1.323300      0.7809000    
 C    4.570600     -1.6400000E-02  0.8277000    
 C   0.7650000       3.005600      -1.953700    
 C    6.116200      1.2700000E-02   2.634900    
 H   -3.137100     -0.2029000       2.689800    
 H   -3.809200      -1.723300     -4.2700000E-02
 H   -2.222000      -1.328800      0.5973000    
 H   -3.447400     -0.4070000      -2.057000    
 H   -4.993200       1.124100       3.723600    
 H   -5.706500       1.481200       2.093700    
 H   -1.756400       1.316500       1.225000    
 H   -3.101400       2.418600      0.8968000    
 H   -1.862500      -1.827800      -3.172900    
 H   -2.699700      -2.783800      -1.942000    
 H   -6.213800      -1.411000       4.073200    
 H   -4.505300      -1.051900       4.372300    
 H   -4.958400      -2.432400       3.367900    
 H   -5.410800     -6.6399999E-02 -5.8200002E-02
 H   -2.219300      0.9956000      -3.316100    
 H    2.668800       2.734500      0.2911000    
 H    2.571900      -3.103300      0.1481000    
 H    1.803600       3.350400      -1.939900    
 H   0.1232000       3.882700      -2.072500    
 H   0.6264000       2.344100      -2.813100    
 H    5.020500      -2.307500      0.8304000    
 H    4.629300       3.164100       1.092700    
 H    6.758300     -0.7645000       3.059800    
 H    5.220900      9.4599999E-02   3.261100    
 H    6.674400      0.9530000       2.642900    


%chk=000160393-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000160393

0 1
O -4.784320 0.665837 -0.031611
O -1.355433 0.621421 -3.087634
O -2.524815 2.557196 -1.760953
O -0.480203 -3.767381 -1.350979
O 0.256688 2.299347 -0.665878
O 1.957194 -3.072618 -0.510004
O 4.204401 -2.282867 0.496159
O 5.840459 -0.397058 1.334106
O 4.995735 2.385978 1.361326
N -5.291674 -0.286926 2.368392
C -3.531346 0.312599 0.649254
C -3.850716 0.095100 2.137816
C -2.950836 -0.984746 0.026419
C -2.589022 -0.794410 -1.465851
C -4.778299 1.032055 2.893071
C -1.536751 0.344795 -1.653412
C -2.549323 1.505602 0.453309
C -2.166267 1.609005 -1.005372
C -2.021062 -2.066610 -2.114641
C -0.176559 -0.061169 -1.076409
C -5.601737 -1.355516 3.346472
C 0.229111 -1.453608 -1.017533
C -0.712798 -2.528805 -1.472084
C 0.689796 0.947525 -0.644332
C 1.531784 -1.762819 -0.533534
C 1.984521 0.662444 -0.101701
C 2.413555 -0.712661 -0.067594
C 2.835479 1.697678 0.391063
C 3.719413 -0.963466 0.457520
C 4.108756 1.404617 0.890439
C 4.560991 0.050526 0.938185
C 0.587077 3.040875 -1.912487
C 6.356372 0.070237 2.645643
H -3.084114 -0.435124 2.720366
H -3.708957 -1.786246 0.113773
H -2.061129 -1.310152 0.601674
H -3.504324 -0.479757 -2.001464
H -4.627644 1.122073 3.977276
H -5.180589 1.919060 2.394243
H -1.643358 1.331927 1.062877
H -3.031897 2.442368 0.773641
H -1.823913 -1.847576 -3.182900
H -2.733644 -2.908409 -2.064924
H -6.640569 -1.226356 3.696449
H -4.928354 -1.355147 4.232752
H -5.520532 -2.335331 2.844875
H -5.497166 0.220717 0.533384
H -1.864017 1.476031 -3.243033
H 2.458979 2.726367 0.382972
H 2.897232 -3.127580 -0.152768
H 1.650428 3.346591 -1.898204
H -0.071393 3.922340 -1.911929
H 0.379511 2.409791 -2.793534
H 5.138825 -2.259348 0.846087
H 4.605573 3.288242 1.249657
H 7.329606 -0.429434 2.761185
H 5.669321 -0.232213 3.458220
H 6.476452 1.163991 2.633560


