%chk=000023781.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023781

1 1
 O  -0.2235000     -0.4655000     -0.6498000    
 N   -3.749800      0.4097000      0.1888000    
 C   -2.276900      0.6621000     -9.9299997E-02
 C   -4.411800     -0.1922000      -1.042300    
 C   -4.430600       1.725000      0.5390000    
 C   -3.880000     -0.5560000       1.357800    
 C   -1.608100     -0.6738000     -0.3987000    
 C   -2.181000       1.628100      -1.269300    
 C   -5.875500     -0.4405000     -0.7500000    
 C   -3.768400       2.318300       1.763200    
 C   0.6242000      -1.490000     -0.3202000    
 C    1.639700      -1.294400      0.6099000    
 C   0.4535000      -2.728600     -0.9303000    
 C    1.832600      3.0500000E-02   1.270800    
 C    2.493900      -2.348600      0.9336000    
 C    1.307500      -3.782900     -0.6065000    
 C    2.769900      0.9573000      0.5244000    
 C    2.327700      -3.592900      0.3254000    
 C    2.251800       1.815700     -0.4289000    
 C    4.122400      0.9236000      0.8128000    
 C    3.115000       2.668800      -1.116500    
 C    4.985600       1.776800      0.1254000    
 C    4.481900       2.649300     -0.8394000    
 H   -1.793200       1.091300      0.7836000    
 H   -4.345000      0.4970000      -1.886200    
 H   -3.951100      -1.149500      -1.290900    
 H   -4.460000       2.398500     -0.3204000    
 H   -5.467700       1.510900      0.8162000    
 H   -3.087100     -0.3620000       2.087200    
 H   -4.853700     -0.4221000       1.840000    
 H   -3.798300      -1.585900      0.9954000    
 H   -1.997900      -1.146700      -1.302800    
 H   -1.712100      -1.374100      0.4364000    
 H   -2.653600       2.597800      -1.106700    
 H   -1.122900       1.871700      -1.430700    
 H   -2.512900       1.214200      -2.224800    
 H   -6.310900     -0.9777000      -1.601900    
 H   -6.059700      -1.069000      0.1244000    
 H   -6.459000      0.4800000     -0.6625000    
 H   -4.365200       3.177900       2.093300    
 H   -3.714800       1.647100       2.623200    
 H   -2.773500       2.722600       1.558600    
 H  -0.3303000      -2.889100      -1.665200    
 H   0.8666000      0.5302000       1.425600    
 H    2.208800     -0.1166000       2.293300    
 H    3.293000      -2.216400       1.658300    
 H    1.179600      -4.751100      -1.081700    
 H    2.992900      -4.413700      0.5772000    
 H    1.189900       1.847600     -0.6473000    
 H    4.524600      0.2487000       1.562500    
 H    2.722500       3.349700      -1.866100    
 H    6.049900       1.761900      0.3413000    
 H    5.154000       3.313900      -1.374300    


%chk=000023781-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023781

1 1
O -0.159117 -1.049594 0.567908
N -3.461928 0.648357 0.221376
C -1.896279 0.467416 0.141461
C -4.120346 0.103167 -1.074907
C -3.811485 2.154629 0.374272
C -4.001494 -0.110509 1.435251
C -1.483919 -1.016771 -0.039444
C -1.226372 1.347062 -0.923874
C -5.651486 0.182126 -1.123689
C -3.169607 2.853450 1.578189
C 0.726452 -2.105126 0.210650
C 2.078025 -1.908976 0.607128
C 0.304424 -3.271914 -0.461152
C 2.508451 -0.656950 1.358186
C 2.997817 -2.936975 0.297106
C 1.251859 -4.279361 -0.758908
C 2.378742 0.660792 0.588368
C 2.600360 -4.113225 -0.381580
C 2.689571 0.744908 -0.793165
C 2.007528 1.847473 1.271511
C 2.632830 1.983723 -1.473253
C 1.954205 3.089234 0.596860
C 2.265937 3.162284 -0.781355
H -1.535754 0.767391 1.141524
H -3.676634 0.673219 -1.906798
H -3.792441 -0.946285 -1.162009
H -3.513975 2.637393 -0.570162
H -4.910034 2.199935 0.450579
H -3.316835 0.028668 2.283891
H -4.996937 0.277126 1.694909
H -4.080985 -1.181476 1.201922
H -1.429571 -1.287408 -1.113016
H -2.156850 -1.731210 0.476534
H -1.325888 2.426727 -0.729927
H -0.145927 1.122042 -0.886841
H -1.573222 1.127215 -1.949140
H -5.978362 -0.298348 -2.062852
H -6.139582 -0.364222 -0.299527
H -6.033126 1.215435 -1.147455
H -3.549181 3.890240 1.603251
H -3.443874 2.389472 2.540468
H -2.071326 2.914182 1.508950
H -0.743790 -3.423435 -0.739255
H 1.931111 -0.570103 2.298697
H 3.567540 -0.784982 1.656389
H 4.045355 -2.810337 0.594424
H 0.929924 -5.188456 -1.277202
H 3.336312 -4.890735 -0.607815
H 2.988440 -0.160255 -1.335090
H 1.783534 1.802175 2.345131
H 2.893080 2.032565 -2.536655
H 1.693537 4.000014 1.148535
H 2.244294 4.125135 -1.303497


