%chk=000065683.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065683

0 1
 I  -0.9717000      -3.023500       2.262300    
 I  -0.4872000     -0.5747000      -3.307100    
 I   -6.855300     -0.1055000     -0.3213000    
 I   -1.940300       3.025100       1.493200    
 O    2.688500       1.798900      0.3202000    
 O    4.430700       1.577800      -1.162200    
 O   -1.788500      -1.911000     -0.6641000    
 O   -5.029300       2.274500      0.8898000    
 N    5.711100      2.7000001E-02  0.6876000    
 C    4.236600      1.9300001E-02  0.7086000    
 C    3.777900      -1.319000      8.1100002E-02
 C    2.287600      -1.478000     -0.1186000    
 C    3.800500      0.1787000       2.171900    
 C    3.810200       1.198200     -0.1749000    
 C    1.716600      -1.064400      -1.310200    
 C    1.524300      -2.033200      0.8945000    
 C   0.1492000      -2.179000      0.7108000    
 C   0.3415000      -1.210200      -1.494200    
 C  -0.4422000      -1.767500     -0.4837000    
 C    2.234300       2.953800     -0.3928000    
 C   -2.600700     -0.8622000     -0.2746000    
 C    1.264200       2.518200      -1.470100    
 C   -2.025300      0.2713000      0.2731000    
 C   -3.970600     -0.9701000     -0.4417000    
 C   -4.790300      8.8100001E-02 -4.8700001E-02
 C   -2.844800       1.329500      0.6660000    
 C   -4.227300       1.238000      0.5051000    
 H    4.144300      -2.159700      0.6880000    
 H    4.258400      -1.454200     -0.8997000    
 H    4.175500       1.117100       2.598700    
 H    2.710800      0.1989000       2.277800    
 H    4.176700     -0.6443000       2.790800    
 H    6.062000      0.9114000       1.053400    
 H    6.050600     -4.9400002E-02 -0.2705000    
 H    2.338900     -0.6370000      -2.092300    
 H    1.998300      -2.351900       1.819500    
 H    1.721300       3.596600      0.3297000    
 H    3.066100       3.534400     -0.8066000    
 H   0.8304000       3.387100      -1.973100    
 H    1.769200       1.903900      -2.220900    
 H   0.4554000       1.921600      -1.041700    
 H  -0.9578000      0.3888000      0.4224000    
 H   -4.387500      -1.875000     -0.8760000    
 H   -5.953500       2.034900      0.7040000    


%chk=000065683-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065683

0 1
I -1.023118 -3.094387 2.335217
I -0.589370 -0.663650 -3.308967
I -7.159195 -0.596950 -0.366355
I -2.624537 3.181793 1.381160
O 3.331381 2.174998 0.280094
O 4.119788 1.007835 -1.576476
O -1.867251 -1.971925 -0.605064
O -5.547599 2.082245 0.773237
N 5.803277 -0.091708 0.711066
C 4.320507 -0.049232 0.658553
C 3.852126 -1.423825 0.065340
C 2.349428 -1.569558 -0.112202
C 3.786984 0.177439 2.083714
C 3.900458 1.070117 -0.338518
C 1.721737 -1.156503 -1.316263
C 1.549641 -2.121960 0.920434
C 0.152604 -2.229286 0.766004
C 0.324848 -1.266237 -1.466150
C -0.481435 -1.789864 -0.423488
C 2.935845 3.324269 -0.603001
C -2.752044 -0.922808 -0.235538
C 1.488908 3.157004 -1.071070
C -2.315895 0.318269 0.275534
C -4.122449 -1.195870 -0.420148
C -5.056568 -0.200329 -0.086366
C -3.273853 1.296658 0.603135
C -4.663306 1.066397 0.430610
H 4.247252 -2.197098 0.747326
H 4.353214 -1.547673 -0.912730
H 4.154557 1.133212 2.495527
H 2.686445 0.214218 2.101937
H 4.136262 -0.645532 2.731803
H 6.218207 0.664033 1.267231
H 6.244103 -0.186459 -0.211578
H 2.333021 -0.748874 -2.126812
H 2.022788 -2.473681 1.841968
H 3.063913 4.204944 0.046632
H 3.637402 3.366454 -1.454366
H 1.183412 4.042833 -1.658432
H 1.381028 2.267258 -1.714324
H 0.801299 3.063458 -0.212603
H -1.251173 0.519824 0.415386
H -4.425503 -2.167155 -0.816427
H -6.488339 1.800602 0.608471


