%chk=000149712.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149712

0 1
 O   -6.164400      0.2467000       1.638900    
 O  -0.2815000       3.457100     -0.4979000    
 O    6.266400      0.6845000     -0.4055000    
 N   -4.188900       1.943600      0.3994000    
 N    2.510100       2.830700     -0.6375000    
 N  -0.7531000       1.263900      0.1401000    
 N   -2.847100      0.1976000      0.6880000    
 N   -5.019400      -1.579700      0.7825000    
 N    1.934400      0.7844000      5.2999998E-03
 N    4.135400     -0.2023000      6.4000003E-02
 N   -5.897400      -2.223700      -2.236300    
 N   -6.156600      -4.462400      -1.533900    
 N    7.529100      -1.591600      0.1090000    
 N    7.635800      -3.901800      0.7587000    
 N    9.533700      -2.754200      0.2333000    
 C   -4.046200      0.6570000      0.7206000    
 C   -2.117300       1.295300      0.3058000    
 C    1.536600       1.975400     -0.2940000    
 C   -2.928000       2.390400      0.1204000    
 C   -6.031400      -2.562700       1.062400    
 C   -5.172200     -0.2354000       1.098900    
 C   0.1043000       2.317400     -0.2468000    
 C    3.675900       2.122800     -0.5541000    
 C    3.295100      0.8632000     -0.1553000    
 C   -5.396100       2.733000      0.3431000    
 C   -7.013900      -2.725800     -8.9800000E-02
 C    2.389600       4.216500      -1.023700    
 C   -6.312000      -3.186700      -1.354100    
 C    5.536200     -0.2413000     -6.7000002E-02
 C    6.077500      -1.616400      0.2669000    
 C    8.165600      -2.695300      0.3585000    
 H   -2.743100       3.414300     -0.1728000    
 H   -5.511500      -3.506400       1.259600    
 H   -6.571300      -2.277200       1.971700    
 H  -0.3304000      0.3587000      0.3313000    
 H    4.631900       2.574100     -0.7805000    
 H   -4.166200      -1.886300      0.3235000    
 H   -5.756800       2.888400       1.362700    
 H   -6.137200       2.203100     -0.2605000    
 H   -5.175700       3.698300     -0.1206000    
 H   -7.529000      -1.779600     -0.2926000    
 H   -7.776400      -3.466200      0.1783000    
 H    1.957900       4.776900     -0.1909000    
 H    3.382000       4.615200      -1.251800    
 H    1.761600       4.279900      -1.915700    
 H    3.661600      -1.053800      0.3552000    
 H    5.798400      -1.851000       1.300600    
 H    5.620000      -2.339100     -0.4188000    
 H   -5.427500      -2.471000      -3.100400    
 H   -6.035900      -1.235300      -2.053800    
 H   -5.675300      -4.612900      -2.427300    
 H    6.640700      -4.034700      0.8997000    
 H    8.232200      -4.705000      0.9258000    
 H    10.04750      -3.607400      0.4241000    
 H    10.06860      -1.942100     -5.4499999E-02


%chk=000149712-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149712

0 1
O -6.401126 0.127159 0.074872
O -0.282678 3.996963 0.227828
O 6.361667 1.142697 0.336015
N -4.209975 2.217211 0.224266
N 2.649441 3.358295 0.261211
N -0.646218 1.670925 0.236375
N -2.745164 0.483833 0.196702
N -4.684874 -1.465089 0.230073
N 2.056745 1.163622 0.287584
N 4.241701 0.126895 0.343081
N -3.397685 -2.891991 -2.164418
N -4.257437 -5.142747 -1.863189
N 5.102297 -2.305538 0.416422
N 6.666354 -4.147824 0.387770
N 4.355379 -4.517219 0.191323
C -4.064729 0.833584 0.199557
C -2.042412 1.682330 0.226699
C 1.596140 2.448683 0.260221
C -2.929351 2.774752 0.242672
C -5.564792 -2.637238 0.146330
C -5.161051 -0.170395 0.165914
C 0.163650 2.799665 0.239885
C 3.834377 2.621802 0.288811
C 3.440617 1.268025 0.306637
C -5.464702 2.995604 0.246977
C -5.675748 -3.237071 -1.285412
C 2.564098 4.830328 0.226676
C -4.372623 -3.831034 -1.806049
C 5.619059 0.112018 0.357023
C 6.192774 -1.316656 0.410851
C 5.386088 -3.588123 0.344777
H -2.732699 3.840209 0.263748
H -5.197273 -3.411786 0.842999
H -6.569491 -2.316666 0.472265
H -0.165113 0.762631 0.251953
H 4.825345 3.061223 0.295301
H -3.668544 -1.573534 0.318812
H -5.543164 3.555077 1.194969
H -6.306073 2.292905 0.157552
H -5.476452 3.707122 -0.595974
H -6.049722 -2.452260 -1.969769
H -6.411874 -4.056482 -1.262963
H 1.922335 5.192823 1.043586
H 3.579975 5.242309 0.331900
H 2.120911 5.167480 -0.724006
H 3.823682 -0.822263 0.371241
H 6.880876 -1.419435 -0.458255
H 6.824383 -1.355993 1.327054
H -2.494335 -3.189631 -2.528989
H -3.574308 -1.892140 -2.077835
H -3.328081 -5.457687 -2.218927
H 7.467442 -3.558315 0.593743
H 6.839622 -5.088030 0.041074
H 4.450798 -5.458576 0.566335
H 3.418239 -4.131349 0.098899


