%chk=000146256.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146256

0 1
 O  -0.4584000      -1.487800     -0.4391000    
 O    1.806300      -2.999800      -1.134700    
 N    2.473800      0.1219000      0.7436000    
 C    3.006000       1.408700      0.3333000    
 C    2.379700     -0.7934000     -0.3880000    
 C    1.803500      -2.152000      1.7400000E-02
 C    4.411000       1.213700     -0.2483000    
 C    2.084400       2.016100     -0.7294000    
 C    3.078500       2.338400       1.550100    
 C   0.3778000      -2.066400      0.5581000    
 C   -1.542300     -0.7777000      3.1000001E-03
 C   -2.041300      0.2892000     -0.7380000    
 C   -3.147000      0.9999000     -0.2708000    
 C   -2.138800      -1.140500       1.207200    
 C   -1.393400      0.6701000      -2.030700    
 C   -3.748500      0.6403000      0.9353000    
 C   -3.244400     -0.4298000       1.674200    
 C   -3.706900       2.149100      -1.043400    
 H    3.059000     -0.2909000       1.469500    
 H    1.756700     -0.4103000      -1.201200    
 H    3.361500      -1.004500     -0.8260000    
 H    2.452300      -2.620900      0.7670000    
 H    4.414300      0.7479000      -1.239300    
 H    4.906600       2.184600     -0.3744000    
 H    5.047700      0.6183000      0.4171000    
 H    1.034500       1.991100     -0.4144000    
 H    2.166300       1.539200      -1.711400    
 H    2.338600       3.071200     -0.8917000    
 H    3.733000       1.928200       2.328200    
 H    3.471000       3.324200       1.275300    
 H    2.087500       2.489700       1.994100    
 H   0.3929000      -1.478500       1.484300    
 H   5.5999998E-03  -3.075100      0.7729000    
 H    1.472400      -3.870400     -0.8586000    
 H   -1.801800      -1.985800       1.799200    
 H   -1.052100       1.709900      -1.997600    
 H  -0.5172000      5.9599999E-02  -2.268500    
 H   -2.098800      0.5487000      -2.859600    
 H   -4.611500       1.181900       1.313200    
 H   -3.717700     -0.7142000       2.609500    
 H   -2.964400       2.947900      -1.138900    
 H   -4.026700       1.826800      -2.039700    
 H   -4.584000       2.581200     -0.5488000    


%chk=000146256-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000146256

0 1
O -0.398076 -0.926105 -0.344026
O 1.386511 -2.837612 -1.228595
N 3.118028 -0.148960 0.772371
C 3.568717 1.280109 0.682816
C 2.588104 -0.805638 -0.443506
C 1.710167 -2.020336 -0.050073
C 4.633049 1.499473 -0.433904
C 2.342046 2.192088 0.429273
C 4.182557 1.627358 2.061232
C 0.429624 -1.596723 0.680735
C -1.657367 -0.413315 0.033251
C -2.399721 0.226422 -1.001149
C -3.684499 0.753671 -0.686839
C -2.161868 -0.520653 1.351355
C -1.831505 0.331812 -2.405002
C -4.191871 0.641034 0.633579
C -3.435497 0.012117 1.643307
C -4.513430 1.438280 -1.760176
H 3.856654 -0.723002 1.205801
H 1.958313 -0.086687 -0.996487
H 3.369461 -1.173694 -1.144980
H 2.287977 -2.691462 0.612841
H 4.228864 1.226175 -1.425864
H 4.949056 2.558478 -0.478251
H 5.531595 0.880728 -0.246944
H 1.569988 2.013525 1.198149
H 1.887465 2.011207 -0.561721
H 2.642564 3.255125 0.467035
H 5.056109 0.982600 2.282381
H 4.525377 2.677097 2.083372
H 3.434788 1.482336 2.860975
H 0.682305 -0.894795 1.497769
H -0.112546 -2.480603 1.069425
H 0.630476 -2.385811 -1.688535
H -1.581620 -1.008470 2.139053
H -1.918843 1.362161 -2.796972
H -0.769870 0.043524 -2.424726
H -2.377286 -0.326082 -3.109953
H -5.182321 1.048996 0.864815
H -3.834332 -0.068380 2.660584
H -4.016504 2.352855 -2.138354
H -4.674538 0.779858 -2.634892
H -5.502402 1.731097 -1.369072


