%chk=000172267.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000172267

0 1
 O    4.214000     -0.8723000       1.437600    
 N   -2.183700     -0.1355000      0.5198000    
 C  -0.7440000      7.3200002E-02  0.6663000    
 C  -0.1048000      -1.137100       1.349600    
 C  -9.4499998E-02  0.3049000     -0.7049000    
 C    1.379700     -0.8785000       1.607900    
 C    1.414400      0.2813000     -0.6564000    
 C    2.107000     -0.3134000      0.4140000    
 C   -2.448300      -1.302000     -0.3217000    
 C   -2.818300       1.055600     -4.3800000E-02
 C   -3.951800      -1.537200     -0.4438000    
 C   -2.622400       2.250400      0.8860000    
 C    2.138300      0.8129000      -1.734700    
 C    3.510100     -0.3312000      0.4011000    
 C    3.532300      0.7795000      -1.740200    
 C    4.218000      0.2100000     -0.6716000    
 C   -4.253600      -2.759200      -1.297700    
 C   -3.292200       3.498700      0.3325000    
 H  -0.5238000      0.9123000       1.333400    
 H  -0.1553000      -2.037200      0.7265000    
 H  -0.6037000      -1.366300       2.299200    
 H  -0.3895000       1.283300      -1.101600    
 H  -0.3422000     -0.4508000      -1.452800    
 H    1.842000      -1.822300       1.921600    
 H    1.482800     -0.1676000       2.437500    
 H   -2.075200      -1.210700      -1.344700    
 H   -2.038500      -2.218800      0.1103000    
 H   -2.501700       1.284600      -1.067500    
 H   -3.904700      0.9348000     -8.0799997E-02
 H   -4.402200      -1.667600      0.5474000    
 H   -4.467900     -0.7115000     -0.9412000    
 H   -3.027100       2.033100       1.881900    
 H   -1.570400       2.521200       1.006900    
 H    1.616500       1.257100      -2.579000    
 H    4.081900       1.198000      -2.578300    
 H    5.304500      0.1951000     -0.6866000    
 H   -3.857200      -2.640400      -2.311400    
 H   -3.814700      -3.661800     -0.8605000    
 H   -5.335000      -2.912200      -1.372800    
 H   -2.877300       3.767200     -0.6445000    
 H   -4.370600       3.348600      0.2186000    
 H   -3.138800       4.344500       1.010300    
 H    5.165600     -0.7933000       1.253600    


%chk=000172267-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000172267

0 1
O 4.183570 -0.682109 1.766290
N -2.098808 0.004335 0.094813
C -0.623119 0.087054 0.266886
C -0.062692 -1.036589 1.167220
C 0.181954 0.108061 -1.065662
C 1.402348 -0.743510 1.557760
C 1.693325 0.129683 -0.853060
C 2.257256 -0.293308 0.380530
C -2.612988 -1.147252 -0.684257
C -2.740325 1.303398 -0.226422
C -3.985944 -1.639303 -0.171131
C -3.025215 2.163480 1.026962
C 2.541322 0.564776 -1.905921
C 3.670964 -0.265260 0.516683
C 3.941762 0.574578 -1.750826
C 4.518496 0.155783 -0.530948
C -4.540008 -2.813093 -1.007602
C -3.650071 3.530304 0.672110
H -0.431351 1.044440 0.793966
H -0.114984 -2.007951 0.635401
H -0.691318 -1.120681 2.072221
H -0.114966 0.977197 -1.684473
H -0.086233 -0.796858 -1.649896
H 1.865757 -1.629183 2.030219
H 1.428029 0.046976 2.336490
H -2.698044 -0.919706 -1.777363
H -1.893682 -1.983259 -0.595941
H -2.129938 1.903734 -0.946057
H -3.701454 1.101912 -0.737374
H -3.873890 -1.935390 0.889076
H -4.709473 -0.800038 -0.185505
H -3.696203 1.591287 1.695363
H -2.083794 2.318872 1.590148
H 2.093834 0.895334 -2.850791
H 4.586839 0.909455 -2.570402
H 5.608478 0.163255 -0.397827
H -4.672370 -2.521812 -2.067257
H -3.853411 -3.680810 -0.982745
H -5.520867 -3.150059 -0.625809
H -2.976083 4.122664 0.024089
H -4.607493 3.403487 0.131390
H -3.853463 4.126090 1.580381
H 5.171951 -0.640584 1.764770


