%chk=000146795.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146795

0 1
 O    1.642700       2.714700      -2.165600    
 O   -1.246800       1.358900      0.8548000    
 N    2.174500      0.4086000       1.833700    
 N   -6.690100      -1.162400     -0.6212000    
 C   0.8572000       1.657600     -0.2572000    
 C    2.228700       1.491700     -0.2925000    
 C   0.1145000       1.205300      0.8129000    
 C   0.4141000       2.331900      -1.499200    
 C    2.769900       2.042000      -1.551800    
 C    2.855300      0.8658000      0.7575000    
 C   -3.507400      0.6530000      0.4083000    
 C   -4.387900     -0.4593000     -0.1588000    
 C   0.8260000      0.5900000       1.832600    
 C    4.330500      0.6594000      0.7532000    
 C   -2.027700      0.3088000      0.3000000    
 C   -5.867100     -8.5299999E-02 -8.3499998E-02
 C   -8.103900     -0.8225000     -0.5459000    
 C    4.768000     -0.6496000      0.1254000    
 C   0.1022000      7.2600000E-02   3.033300    
 C   -8.880400      -1.651600      -1.564000    
 C   -8.629900      -1.056700      0.8674000    
 C    5.041800     -0.7105000      -1.241100    
 C    4.897200      -1.792800      0.9142000    
 C    5.444600      -1.914600      -1.818800    
 C    5.300100      -2.996900      0.3364000    
 C    5.573700      -3.057600      -1.030100    
 H  -0.1670000       3.236400      -1.301100    
 H  -0.1388000       1.654600      -2.156300    
 H    3.090600       1.258700      -2.240800    
 H    3.563300       2.776700      -1.395000    
 H   -3.760600      0.8398000       1.459300    
 H   -3.697200       1.596200     -0.1189000    
 H   -4.106500     -0.6510000      -1.202100    
 H   -4.209300      -1.387000      0.3995000    
 H    4.842100       1.495100      0.2587000    
 H    4.699100      0.6950000       1.787900    
 H   -1.824900     -0.6272000      0.8326000    
 H   -1.757900      0.1680000     -0.7537000    
 H   -6.117700      0.1153000      0.9636000    
 H   -6.032400      0.8390000     -0.6509000    
 H   -8.262700      0.2303000     -0.8140000    
 H   -6.421400      -1.324200      -1.591800    
 H  -0.4854000     -0.8131000       2.775400    
 H   0.8094000     -0.2133000       3.819400    
 H  -0.5595000      0.8385000       3.450400    
 H   -9.947400      -1.406000      -1.530000    
 H   -8.530000      -1.456500      -2.583700    
 H   -8.778200      -2.725400      -1.370000    
 H   -8.459300      -2.089600       1.192100    
 H   -9.709200     -0.8722000      0.9092000    
 H   -8.163000     -0.3898000       1.598600    
 H    4.978300      0.1738000      -1.866000    
 H    4.685700      -1.758800       1.979700    
 H    5.664700      -1.960500      -2.881300    
 H    5.400800      -3.887100      0.9504000    
 H    5.888900      -3.994800      -1.479600    


%chk=000146795-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146795

0 1
O 1.478430 1.328311 -2.694182
O -1.264814 1.029603 1.038230
N 2.287426 0.905227 1.960258
N -7.020846 -0.622019 -0.768289
C 0.781002 1.033770 -0.427291
C 2.195482 0.989412 -0.450707
C 0.122577 0.987418 0.822049
C 0.268528 1.181826 -1.852816
C 2.687621 1.043919 -1.879887
C 2.932396 0.921955 0.749286
C -3.568980 0.428709 0.616427
C -4.630928 -0.054518 -0.397092
C 0.925048 0.937324 2.008481
C 4.452945 0.864723 0.775348
C -2.176196 0.512219 -0.010822
C -6.027306 -0.196683 0.240824
C -8.425872 -0.750647 -0.293129
C 5.031829 -0.417963 0.175070
C 0.269975 0.927208 3.370548
C -9.351349 -0.865077 -1.521543
C -8.581709 -1.981873 0.626604
C 6.006064 -0.370937 -0.852899
C 4.611342 -1.686325 0.655099
C 6.552014 -1.560129 -1.390496
C 5.153556 -2.875359 0.121132
C 6.126990 -2.817327 -0.905009
H -0.348823 2.089567 -1.995927
H -0.310297 0.300591 -2.197374
H 3.138959 0.084028 -2.203222
H 3.419615 1.853626 -2.062455
H -3.529875 -0.258265 1.483426
H -3.841219 1.427355 1.008780
H -4.687596 0.661703 -1.245031
H -4.342567 -1.033381 -0.827566
H 4.872934 1.738628 0.239387
H 4.751386 0.955898 1.835607
H -1.824620 -0.486666 -0.339610
H -2.183581 1.199531 -0.879723
H -5.980024 -0.963339 1.037650
H -6.304580 0.767970 0.741469
H -8.733024 0.155722 0.291584
H -6.977152 -0.009534 -1.596645
H -0.436238 0.082432 3.468259
H 1.049053 0.850435 4.144185
H -0.321327 1.846688 3.536576
H -10.405941 -0.965174 -1.209422
H -9.274016 0.029460 -2.169937
H -9.076554 -1.751695 -2.121793
H -8.274244 -2.894077 0.084295
H -9.634008 -2.093129 0.946923
H -7.962768 -1.897379 1.538038
H 6.342975 0.602369 -1.232441
H 3.858234 -1.733329 1.450788
H 7.305062 -1.504343 -2.184942
H 4.821209 -3.846846 0.504972
H 6.548100 -3.740210 -1.319443


