%chk=000152269.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152269

0 1
 O    1.073200      -1.671000     -3.7000000E-03
 O   -2.067500       1.796900      6.5099999E-02
 O   -6.241300     -5.2099999E-02   1.148500    
 N    1.811800       1.913100     -0.5564000    
 N    2.100400       4.702200      0.1771000    
 N   -1.429800     -0.8817000      -1.104600    
 N   -4.693200      -1.403200      5.6699999E-02
 N   -2.866500      -2.586400      -1.092600    
 N   -4.164800      0.8931000      0.6179000    
 C    2.116300      0.4905000     -0.4177000    
 C   0.7931000     -0.2840000     -0.2017000    
 C    1.213600       2.441600      0.6764000    
 C    3.017000       2.672700     -0.9126000    
 C    3.173100      0.3299000      0.6985000    
 C  -0.2101000     -0.1523000      -1.356600    
 C   0.9052000       3.933900      0.5325000    
 C    2.698000       4.163800      -1.046900    
 C    4.002400     -0.9288000      0.6114000    
 C   -2.559100     -0.4252000     -0.4877000    
 C   -1.663400      -2.187700      -1.450500    
 C   -3.421500      -1.487400     -0.4935000    
 C    3.565700      -2.075500       1.255200    
 C    5.184800     -0.9141000     -0.1108000    
 C   -2.855800      0.8553000      6.8000004E-02
 C   -5.120600     -0.1860000      0.6437000    
 C    4.331700      -3.238300       1.174700    
 C    5.950900      -2.077000     -0.1914000    
 C    5.524400      -3.239100      0.4514000    
 C   -5.582200      -2.557900      3.0900000E-02
 C   -4.585800       2.154500       1.218700    
 H    2.551300      0.1295000      -1.360500    
 H   0.3106000      5.5000000E-03  0.7354000    
 H    1.871000       2.327500       1.546600    
 H   0.2645000       1.966300      0.9239000    
 H    3.402200       2.317600      -1.876500    
 H    3.841600       2.624300     -0.2006000    
 H    3.900800       1.130400      0.8207000    
 H    2.659700      0.3079000       1.671400    
 H  -0.4687000      0.8877000      -1.572800    
 H   0.2197000     -0.5712000      -2.275500    
 H   0.5126000       4.314800       1.481900    
 H   0.1228000       4.089000     -0.2216000    
 H    2.023200       4.331400      -1.896200    
 H    3.620600       4.714400      -1.261900    
 H    1.846900       5.678800      3.1500001E-02
 H    1.478100      -2.009900     -0.8205000    
 H  -0.9263000      -2.794600      -1.958700    
 H    2.660800      -2.083600       1.855200    
 H    5.523200     -1.4400000E-02 -0.6169000    
 H    4.004200      -4.140800       1.682600    
 H    6.879400      -2.077700     -0.7548000    
 H    6.121800      -4.144000      0.3903000    
 H   -6.544400      -2.337400      0.5000000    
 H   -5.107500      -3.383300      0.5703000    
 H   -5.755500      -2.849200      -1.009600    
 H   -3.814100       2.925900       1.170400    
 H   -4.848900       1.972100       2.265500    
 H   -5.481900       2.506800      0.6980000    


%chk=000152269-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000152269

0 1
O 0.987597 -1.818482 0.161612
O -1.982828 1.832630 0.369926
O -6.291406 0.068743 1.115258
N 1.820920 1.857863 -0.358813
N 1.963774 4.713172 -0.219862
N -1.422942 -0.824256 -1.200615
N -4.786834 -1.258957 -0.103037
N -3.024207 -2.454702 -1.362377
N -4.142832 0.919759 0.717015
C 2.087470 0.415260 -0.139015
C 0.754219 -0.378565 -0.048200
C 1.234572 2.592741 0.797440
C 2.971411 2.593235 -0.941429
C 3.033195 0.086351 1.087350
C -0.114972 -0.154729 -1.307294
C 0.797341 3.997783 0.348850
C 2.526220 3.999725 -1.385636
C 4.009443 -1.050291 0.818435
C -2.558075 -0.351344 -0.517356
C -1.751644 -2.082319 -1.669464
C -3.516219 -1.373449 -0.646417
C 3.855242 -2.325735 1.423958
C 5.106931 -0.852198 -0.064143
C -2.805582 0.875987 0.190412
C -5.146220 -0.089240 0.603533
C 4.770272 -3.370624 1.158005
C 6.020550 -1.894671 -0.334357
C 5.855166 -3.160647 0.275776
C -5.765764 -2.352991 -0.256781
C -4.550049 2.128169 1.470331
H 2.612734 0.065261 -1.055771
H 0.176605 -0.063893 0.838317
H 1.968957 2.697598 1.631670
H 0.344103 2.055020 1.160086
H 3.347631 2.028903 -1.816327
H 3.811433 2.710004 -0.211578
H 3.606009 1.007703 1.310180
H 2.418219 -0.139299 1.977137
H -0.263977 0.928635 -1.436904
H 0.402200 -0.557565 -2.197413
H 0.420894 4.557429 1.224041
H -0.041849 3.878975 -0.376446
H 1.790365 3.881495 -2.219790
H 3.400473 4.558093 -1.768484
H 1.766406 5.702242 -0.417169
H 1.850743 -2.085030 -0.248589
H -1.046353 -2.700223 -2.218112
H 3.015629 -2.494460 2.107918
H 5.254541 0.132417 -0.527204
H 4.636149 -4.346014 1.639399
H 6.864648 -1.719695 -1.011351
H 6.565179 -3.969453 0.070400
H -6.686938 -2.050070 0.261452
H -5.364663 -3.280933 0.183471
H -5.968908 -2.530581 -1.326090
H -3.689612 2.812681 1.480715
H -4.840050 1.853737 2.497726
H -5.417617 2.602409 0.983214


