%chk=000010154.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010154

0 1
 O   0.5478000       2.827700      1.4100000E-02
 O   -1.857600       4.014700      8.8600002E-02
 O    4.424200      0.4095000      0.8081000    
 O    4.460000      -2.225200     -6.5099999E-02
 N   -2.860100      -2.318000     -0.2740000    
 C   -1.591100      -1.672600      0.1524000    
 C   -1.654000     -0.1422000      0.1067000    
 C  -0.3979000      -2.146900     -0.7080000    
 C   -2.900600      0.5138000      0.1151000    
 C   -3.991600      -1.731400      0.4620000    
 C  -0.4485000      0.6051000      0.1216000    
 C   -4.180900     -0.2720000      5.8499999E-02
 C   0.8852000      -1.457800     -0.3003000    
 C   0.8502000     -0.1064000      0.1058000    
 C  -0.5417000       2.008600      0.1168000    
 C   -2.953000       1.910900      0.1081000    
 C   -2.847100      -3.768100     -5.2999999E-02
 C   -1.778900       2.653700      0.1122000    
 C    2.101600      -2.154400     -0.3685000    
 C    2.065000      0.4954000      0.4803000    
 C    3.271200     -0.2092000      0.4266000    
 C    3.290300      -1.531000     -3.1000001E-03
 C   0.9502000       3.201600      -1.299800    
 C    5.157300       1.094200     -0.2051000    
 H   -1.395200      -1.934300       1.203900    
 H  -0.5762000      -1.941400      -1.772000    
 H  -0.2580000      -3.227600     -0.5972000    
 H   -3.835700      -1.812000       1.546500    
 H   -4.922500      -2.264200      0.2299000    
 H   -4.927400      0.1824000      0.7210000    
 H   -4.569400     -0.2207000     -0.9667000    
 H   -3.917900       2.412400      9.2000000E-02
 H   -2.624400      -4.025800      0.9886000    
 H   -2.121600      -4.265900     -0.7027000    
 H   -3.818300      -4.206100     -0.3121000    
 H    2.118900      -3.189100     -0.7030000    
 H    2.114500       1.500500      0.8843000    
 H   -2.793200       4.280300      8.2500003E-02
 H    1.077100       2.322700      -1.940200    
 H    1.910700       3.719800      -1.228300    
 H   0.2207000       3.884200      -1.746200    
 H    5.175900      -1.656300      0.2663000    
 H    4.565500       1.921100     -0.6106000    
 H    5.443800      0.4091000      -1.009300    
 H    6.065600       1.502900      0.2460000    


%chk=000010154-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000010154

0 1
O 0.777781 2.705754 -0.399867
O -1.644119 4.044413 -0.276826
O 4.653609 -0.025010 0.348707
O 4.447664 -2.569547 -0.463625
N -2.855127 -2.362047 -0.024567
C -1.525879 -1.711377 0.133215
C -1.597786 -0.183035 0.008512
C -0.501749 -2.224663 -0.905000
C -2.833900 0.499798 0.048768
C -3.895541 -1.667013 0.772352
C -0.363924 0.538063 -0.150533
C -4.137415 -0.267589 0.192354
C 0.851532 -1.605220 -0.608195
C 0.909322 -0.234580 -0.209340
C -0.414841 1.960116 -0.267888
C -2.858868 1.910305 -0.048662
C -2.818090 -3.806913 0.289207
C -1.664103 2.634487 -0.198725
C 2.033135 -2.374036 -0.695492
C 2.175491 0.327905 0.128028
C 3.338305 -0.450392 0.044247
C 3.278703 -1.806612 -0.380302
C 0.911003 3.502774 -1.639051
C 4.823118 1.350819 0.816738
H -1.108789 -1.946833 1.153074
H -0.867533 -1.945448 -1.913784
H -0.419281 -3.324041 -0.875004
H -3.606007 -1.587915 1.852624
H -4.825606 -2.262345 0.723092
H -4.843467 0.293208 0.835396
H -4.614522 -0.378322 -0.801203
H -3.820407 2.440338 0.001666
H -2.459219 -4.020961 1.328214
H -2.164389 -4.346447 -0.415526
H -3.834638 -4.224731 0.183835
H 1.998112 -3.424513 -1.000845
H 2.217732 1.371993 0.438771
H -2.561432 4.399859 -0.174576
H 0.834598 2.847418 -2.527517
H 1.916447 3.949268 -1.588223
H 0.142481 4.292766 -1.674897
H 5.210080 -1.993308 -0.188183
H 4.264255 1.520929 1.756568
H 4.484051 2.074047 0.050640
H 5.902112 1.470638 0.994524


