%chk=000028338.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028338

0 1
 O   0.1868000       1.147100      0.8717000    
 O    2.047100      -2.587300      -1.182900    
 O   -2.369200      -2.626000      2.6900001E-02
 O   -5.948900       2.379600     -0.6360000    
 N    1.228500     -0.7400000     -1.3000000E-02
 N  -0.1396000      -2.601900     -0.5191000    
 C    2.467400     -2.8400000E-02 -0.2155000    
 C    2.251100       1.190500      -1.116300    
 C    3.080900      0.3737000       1.127800    
 C    3.538900       1.989100      -1.300000    
 C    4.366900       1.174900      0.9418000    
 C    4.150000       2.387100      4.0399998E-02
 C  -0.9636000     -0.9567000       1.062200    
 C   0.1789000     -5.9099998E-02  0.6234000    
 C   -2.229600     -0.1471000       1.339100    
 C    1.123100      -2.018400     -0.5953000    
 C   -1.256900      -2.113800      0.1365000    
 C   -2.836000      0.3894000      4.6000000E-02
 C   -4.118200       1.170800      0.3237000    
 C   -4.757800       1.676800     -0.9614000    
 H    3.196100     -0.6764000     -0.7181000    
 H    1.497700       1.887100     -0.7429000    
 H    1.890900      0.8598000      -2.098900    
 H    3.298200     -0.5254000       1.718200    
 H    2.396800      0.9750000       1.735500    
 H    3.336400       2.886800      -1.895300    
 H    4.262200       1.389200      -1.866300    
 H    5.138500      0.5291000      0.5045000    
 H    4.742600       1.502700       1.917600    
 H    5.104800       2.898100     -0.1266000    
 H    3.488200       3.102000      0.5446000    
 H  -0.6360000      -1.404400       2.011300    
 H   -2.016300      0.6822000       2.024800    
 H   -2.966500     -0.7842000       1.845100    
 H   -2.124000       1.049000     -0.4638000    
 H   -3.074800     -0.4146000     -0.6564000    
 H  -0.2668000      -3.461300      -1.046500    
 H   -3.907600       2.018800      0.9873000    
 H   -4.838600      0.5410000      0.8608000    
 H   -5.023600      0.8462000      -1.622300    
 H   -4.089600       2.352400      -1.504800    
 H   -5.701100       3.133200     -7.3600002E-02


%chk=000028338-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028338

0 1
O 0.467935 0.619463 2.024889
O 1.515669 -2.135397 -1.627100
O -2.110406 -3.337081 0.985140
O -5.267550 2.565647 -1.521214
N 1.003939 -0.687854 0.163383
N -0.284603 -2.672984 -0.276335
C 2.172684 0.193794 -0.214335
C 1.711648 1.624586 -0.583453
C 3.281161 0.190905 0.866940
C 2.927564 2.460761 -1.054029
C 4.484438 1.039193 0.384439
C 4.047827 2.476731 0.013751
C -1.046177 -1.207912 1.564785
C 0.201118 -0.364300 1.282406
C -2.329683 -0.315539 1.427379
C 0.792362 -1.838127 -0.641258
C -1.207142 -2.490098 0.762679
C -2.577589 0.223346 0.001758
C -3.817450 1.145453 -0.051290
C -4.068740 1.714942 -1.459769
H 2.582005 -0.281138 -1.124789
H 1.248426 2.106433 0.295784
H 0.950191 1.573245 -1.386171
H 3.602063 -0.849672 1.066154
H 2.884490 0.609553 1.808430
H 2.599168 3.492748 -1.282008
H 3.328487 2.036253 -1.997700
H 4.948611 0.558381 -0.501515
H 5.257254 1.063949 1.176024
H 4.916394 3.054743 -0.355950
H 3.678547 2.992649 0.923552
H -0.988681 -1.502267 2.630464
H -2.215473 0.526279 2.134606
H -3.190704 -0.925935 1.756126
H -1.688330 0.787670 -0.348442
H -2.720921 -0.620213 -0.703624
H -0.385409 -3.515757 -0.852348
H -3.679162 1.983000 0.665355
H -4.718789 0.590483 0.273444
H -4.277180 0.902294 -2.176386
H -3.171306 2.269013 -1.814225
H -5.149382 3.329360 -0.901345


