%chk=000150062.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150062

0 1
 O   -2.482100       1.978600      -1.080700    
 O    2.666100       2.979800       1.701600    
 O   -4.917000      0.7201000     -0.6181000    
 O    4.539300       2.591600     -0.3307000    
 N    1.052800      -2.626200     -0.2363000    
 C   0.9589000      -1.434500      0.5502000    
 C  -0.1685000      -1.408100       1.565700    
 C    1.836600     -0.3968000      0.3792000    
 C    2.876200     -0.5518000     -0.6705000    
 C   -1.425500     -0.8410000      0.9855000    
 C    2.042300      -2.721900      -1.213100    
 C    2.942700      -1.765200      -1.468200    
 C    1.819600      0.8345000       1.163300    
 C   0.1272000      -3.750200     -5.6000002E-02
 C    3.760500      0.4354000     -0.8949000    
 C   -1.371700      0.3171000      0.2141000    
 C   -2.643300      -1.474300       1.219500    
 C    2.696500       1.825000      0.9494000    
 C    3.731700       1.695100     -0.1096000    
 C   -2.543600      0.8455000     -0.3272000    
 C   -3.815400     -0.9458000      0.6784000    
 C   -3.765500      0.2140000     -9.4999999E-02
 C   -2.287600       1.814000      -2.484100    
 C   -5.630200       1.664800      0.1776000    
 H   0.1006000     -0.8110000       2.444900    
 H  -0.3405000      -2.400300       1.996300    
 H    2.044600      -3.649600      -1.774400    
 H    3.694600      -1.887500      -2.238900    
 H    1.085300      0.9662000       1.949600    
 H   0.3076000      -4.548800     -0.7856000    
 H  -0.9109000      -3.435600     -0.1959000    
 H   0.2503000      -4.199900      0.9348000    
 H    4.531300      0.3595000      -1.656100    
 H  -0.4562000      0.8513000      5.5999998E-03
 H   -2.697000      -2.378000       1.820400    
 H   -4.763700      -1.443300      0.8627000    
 H    3.383300       3.553900       1.381700    
 H   -1.333500       1.315200      -2.682700    
 H   -2.267000       2.805000      -2.945600    
 H   -3.110200       1.240500      -2.922700    
 H   -6.517900       1.979500     -0.3778000    
 H   -5.011700       2.545700      0.3770000    
 H   -5.949900       1.208600       1.119700    


%chk=000150062-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150062

0 1
O -2.724811 1.824908 -1.271578
O 3.159964 2.845206 1.964796
O -5.203706 0.478821 -0.466403
O 5.082703 2.547945 0.230275
N 1.090282 -2.478759 -0.336230
C 1.064646 -1.385526 0.535262
C -0.074204 -1.328091 1.540319
C 2.066284 -0.387166 0.452875
C 3.155609 -0.523155 -0.533978
C -1.418018 -0.856487 0.966392
C 2.106266 -2.613717 -1.283335
C 3.114441 -1.679437 -1.389639
C 2.066814 0.778996 1.305670
C 0.067167 -3.548401 -0.252146
C 4.177039 0.437658 -0.634674
C -1.486317 0.250161 0.084901
C -2.620574 -1.512324 1.333143
C 3.082898 1.709094 1.190197
C 4.201467 1.588375 0.213499
C -2.725502 0.702448 -0.413651
C -3.866705 -1.049736 0.857440
C -3.934603 0.066499 -0.002219
C -3.238859 1.568511 -2.638057
C -5.593886 1.855365 -0.073637
H 0.225801 -0.657052 2.362011
H -0.216406 -2.318486 2.011877
H 2.051319 -3.497094 -1.921926
H 3.892307 -1.824040 -2.144676
H 1.275776 0.959546 2.037581
H 0.158100 -4.196323 -1.136845
H -0.945893 -3.116974 -0.236181
H 0.213580 -4.167763 0.651428
H 4.976961 0.316793 -1.372753
H -0.581199 0.775017 -0.238991
H -2.587609 -2.374014 2.011217
H -4.804643 -1.533018 1.149108
H 4.008093 3.301057 1.628959
H -2.576656 0.853990 -3.162536
H -3.212283 2.543982 -3.146344
H -4.270029 1.172634 -2.608169
H -6.566288 2.031566 -0.557635
H -4.847444 2.593097 -0.417726
H -5.702784 1.916990 1.025475


