%chk=000111047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111047

1 1
 O   -2.952500       1.257100      2.4200000E-02
 O    4.329500       3.408900     -0.2114000    
 N   -3.295500     -0.9851000      0.1555000    
 N    3.596400       1.155600     -7.9899997E-02
 C   -4.527300     -0.3686000      0.1209000    
 C   -3.042100      -2.393900      0.2342000    
 C   -2.423400     -3.5999999E-03  9.7300000E-02
 C   -4.314800       1.009400      4.0199999E-02
 C   -5.816000     -0.8963000      0.1529000    
 C   -5.345200       1.938600     -1.3000000E-02
 C   -2.944100      -3.015400      -1.145900    
 C   -1.029700     -0.2385000      0.1091000    
 C   -6.872800      2.4100000E-02  0.1004000    
 C   -6.641700       1.406900      1.9400001E-02
 C  -8.7200001E-02  0.7290000      1.2500000E-02
 C    1.334900      0.4564000      1.3300000E-02
 C    4.084800     -0.2201000      2.9800000E-02
 C    2.260600       1.418700     -8.2500003E-02
 C    4.276900     -0.9130000      -1.126800    
 C    4.311600     -0.7092000       1.280200    
 C    4.569000       2.199100     -0.1464000    
 C    4.741700      -2.224000      -1.022500    
 C    4.776400      -2.020300       1.384600    
 C    4.991600      -2.777700      0.2331000    
 C    6.018900       1.761800     -0.1792000    
 H   -2.144800      -2.605100      0.8237000    
 H   -3.861400      -2.871400      0.7848000    
 H   -6.013600      -1.960500      0.2124000    
 H   -5.162900       3.004100     -7.5499997E-02
 H   -3.864500      -2.853000      -1.716100    
 H   -2.775700      -4.093800      -1.067900    
 H   -2.118000      -2.580200      -1.716800    
 H  -0.6741000      -1.262100      0.1793000    
 H   -7.896700     -0.3420000      0.1221000    
 H   -7.492000       2.084000     -1.9500000E-02
 H  -0.3862000       1.771500     -7.1099997E-02
 H    1.595600     -0.5943000      9.7099997E-02
 H    1.976300       2.463200     -0.1632000    
 H    4.082800     -0.4824000      -2.103400    
 H    4.144800     -0.1202000       2.175800    
 H    4.909200      -2.813700      -1.919100    
 H    4.971000      -2.451200       2.362300    
 H    5.353600      -3.798400      0.3143000    
 H    6.656600       2.649600     -0.2484000    
 H    6.220900       1.143700      -1.057100    
 H    6.290500       1.236100      0.7389000    


%chk=000111047-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111047

1 1
O -2.860566 1.062094 -0.007082
O 3.836519 3.429927 -0.168192
N -3.493431 -1.101806 0.183698
N 3.636643 1.097570 -0.030307
C -4.687939 -0.335158 0.108284
C -3.435019 -2.581594 0.272905
C -2.410703 -0.255724 0.101048
C -4.287394 1.016339 -0.002908
C -6.050076 -0.684318 0.134082
C -5.178855 2.085447 -0.091023
C -3.410362 -3.255544 -1.113026
C -1.032902 -0.565583 0.114330
C -6.974881 0.383094 0.045668
C -6.552316 1.735941 -0.063980
C -0.041158 0.419433 0.043256
C 1.356847 0.158086 0.049401
C 4.278366 -0.211353 0.036987
C 2.263186 1.212482 -0.025161
C 4.553046 -0.911992 -1.159676
C 4.609479 -0.760757 1.296654
C 4.430474 2.329117 -0.111527
C 5.181041 -2.176077 -1.091443
C 5.237778 -2.025271 1.354913
C 5.525329 -2.731734 0.163339
C 5.930009 2.158479 -0.120639
H -2.545236 -2.854056 0.865772
H -4.316255 -2.904647 0.852975
H -6.391027 -1.720020 0.215270
H -4.840921 3.120668 -0.174939
H -4.307094 -2.998803 -1.702268
H -3.387483 -4.351771 -0.987638
H -2.519069 -2.958464 -1.692230
H -0.754155 -1.621713 0.179201
H -8.045831 0.160194 0.061222
H -7.303624 2.528137 -0.129863
H -0.365083 1.468102 -0.023876
H 1.715600 -0.875638 0.113519
H 1.919607 2.253342 -0.086947
H 4.283475 -0.471528 -2.125843
H 4.381846 -0.205388 2.213138
H 5.404243 -2.721632 -2.013888
H 5.504471 -2.454276 2.326076
H 6.017465 -3.708401 0.212283
H 6.391163 3.153807 -0.186182
H 6.261829 1.544302 -0.976381
H 6.284363 1.650486 0.793595


