%chk=000062459.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062459

0 1
 O    5.654100       2.061600      9.1700003E-02
 N    5.148900     -0.2101000     -0.2632000    
 C    3.907900     -0.1156000      -1.000800    
 C    2.686500     -0.1146000     -8.7399997E-02
 C    1.369700     -3.7200000E-02 -0.8655000    
 C   0.1643000     -9.9200003E-02  7.6200001E-02
 C    5.681100      -1.483200      0.1616000    
 C   -1.150400      8.6000003E-03 -0.6994000    
 C    7.106000      -1.146900      0.5535000    
 C   -2.391000     -1.7000001E-02  0.1981000    
 C    7.022000      0.2965000       1.035300    
 C   -3.708200      1.6600000E-02 -0.5819000    
 C    5.881600      0.8686000      0.2261000    
 C   -4.909800     -8.3600000E-02  0.3618000    
 C   -6.258300     -3.3100002E-02 -0.3620000    
 C   -7.459300     -5.8899999E-02  0.5861000    
 C   -8.774500      6.7000002E-02 -0.1842000    
 C   -9.970800      8.0399998E-02  0.7541000    
 H    3.866100     -0.9425000      -1.718100    
 H    3.926400      0.8207000      -1.570800    
 H    2.751000      0.7293000      0.6111000    
 H    2.691500      -1.024400      0.5260000    
 H    1.317700     -0.8654000      -1.582500    
 H    1.342300      0.8944000      -1.443400    
 H   0.1821000      -1.039800      0.6397000    
 H   0.2248000      0.7171000      0.8060000    
 H    5.639300      -2.214200     -0.6506000    
 H    5.096500      -1.837700       1.016500    
 H   -1.154100      0.9369000      -1.284200    
 H   -1.210900     -0.8182000      -1.418200    
 H    7.755400      -1.198300     -0.3294000    
 H    7.511500      -1.826300       1.308300    
 H   -2.362400     -0.9239000      0.8151000    
 H   -2.354100      0.8357000      0.8874000    
 H    6.761100      0.3496000       2.096900    
 H    7.949400      0.8429000      0.8479000    
 H   -3.767500      0.9454000      -1.161500    
 H   -3.735500     -0.8145000      -1.296600    
 H   -4.846900      -1.016900      0.9351000    
 H   -4.863900      0.7376000       1.088100    
 H   -6.325300     -0.8784000      -1.057900    
 H   -6.299700      0.8801000     -0.9691000    
 H   -7.452700     -0.9921000       1.162000    
 H   -7.375000      0.7655000       1.304500    
 H   -8.875600     -0.7684000     -0.8866000    
 H   -8.773800      0.9901000     -0.7756000    
 H   -9.916300      0.9256000       1.447400    
 H   -10.01940     -0.8428000       1.340300    
 H   -10.89990      0.1693000      0.1824000    


%chk=000062459-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000062459

0 1
O 5.813344 2.084781 -0.166004
N 5.252091 -0.205087 -0.281791
C 3.963994 -0.034665 -0.963397
C 2.739042 -0.174025 -0.027292
C 1.407054 -0.006738 -0.791567
C 0.165419 -0.107070 0.123179
C 5.739833 -1.506940 0.213001
C -1.168925 0.018317 -0.646158
C 7.228935 -1.219992 0.566808
C -2.412824 -0.055564 0.267812
C 7.262418 0.302470 0.857345
C -3.746829 0.030733 -0.507688
C 6.057614 0.869421 0.085457
C -4.992444 -0.028330 0.405163
C -6.325818 0.035669 -0.373790
C -7.572474 -0.013908 0.538224
C -8.905485 0.044186 -0.242794
C -10.145631 -0.003293 0.676022
H 3.891133 -0.773029 -1.788164
H 3.976475 0.977914 -1.407780
H 2.813297 0.590235 0.770783
H 2.752996 -1.165498 0.470258
H 1.337409 -0.778425 -1.587258
H 1.401512 0.975548 -1.308015
H 0.185256 -1.075993 0.665112
H 0.219002 0.684549 0.899082
H 5.630786 -2.285451 -0.565427
H 5.165532 -1.835925 1.104077
H -1.181508 0.977756 -1.204458
H -1.227822 -0.785784 -1.409639
H 7.867720 -1.451136 -0.303658
H 7.574763 -1.832256 1.415925
H -2.387186 -1.002786 0.846661
H -2.368187 0.765255 1.013876
H 7.126425 0.528333 1.932115
H 8.189555 0.800369 0.531020
H -3.768662 0.971999 -1.096087
H -3.794664 -0.797399 -1.245780
H -4.963489 -0.962448 1.004751
H -4.952875 0.808770 1.133347
H -6.367741 -0.805919 -1.096914
H -6.352059 0.966028 -0.979286
H -7.546225 -0.942196 1.146967
H -7.534571 0.830170 1.258528
H -8.943081 -0.800112 -0.961379
H -8.929619 0.971055 -0.851848
H -10.145552 0.846495 1.384676
H -10.161205 -0.935507 1.272032
H -11.084829 0.041723 0.094254


