%chk=000003100.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003100

0 1
 O    1.105900     -0.1835000     -7.8100003E-02
 N    3.916600     -0.6273000     -1.2900000E-02
 C  -0.1675000     -7.6399997E-02  0.5436000    
 C  -0.7987000       1.259500      0.2106000    
 C   -1.061200      -1.252900      0.2017000    
 C    1.987500      0.8427000      0.3586000    
 C    3.325100      0.6689000     -0.3428000    
 C   -1.659200       1.844600       1.122300    
 C   -2.011300      -1.664300       1.118100    
 C  -0.4999000       1.864200     -0.9973000    
 C  -0.9042000      -1.884700      -1.018100    
 C    4.096300     -0.7539000       1.433000    
 C    5.194500     -0.7967000     -0.7036000    
 C   -2.240300       3.075100      0.8160000    
 C   -2.833600      -2.746300      0.8037000    
 C   -1.081000       3.094800      -1.303600    
 C   -1.726600      -2.966600      -1.332600    
 C   -1.951200       3.700100     -0.3970000    
 C   -2.691300      -3.397300     -0.4216000    
 H   1.8900000E-02 -0.1197000       1.627200    
 H    1.646900       1.847700      9.9500000E-02
 H    2.081300      0.8350000       1.450200    
 H    3.158100      0.7173000      -1.426300    
 H    3.994100       1.495000     -6.9899999E-02
 H   -1.887600       1.371300       2.072400    
 H   -2.128600      -1.169200       2.077300    
 H   0.1466000       1.401700      -1.737500    
 H  -0.1663000      -1.559600      -1.745300    
 H    3.145000     -0.9029000       1.953000    
 H    4.618800      0.1055000       1.868900    
 H    4.684300      -1.650200       1.666000    
 H    5.612000      -1.790000     -0.5044000    
 H    5.932300     -4.4900000E-02 -0.4002000    
 H    5.058200     -0.7282000      -1.788700    
 H   -2.917100       3.547000       1.522200    
 H   -3.583900      -3.082400       1.513300    
 H  -0.8621000       3.578100      -2.251400    
 H   -1.617600      -3.472300      -2.287500    
 H   -2.404900       4.657500     -0.6363000    
 H   -3.331800      -4.239500     -0.6666000    


%chk=000003100-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000003100

0 1
O 1.043607 -0.002929 -0.116262
N 4.017369 -0.653776 0.123514
C -0.265933 0.025598 0.564505
C -0.981134 1.357459 0.335347
C -1.041963 -1.202305 0.074119
C 2.040451 0.881794 0.494534
C 3.379365 0.638990 -0.210187
C -1.371762 2.170297 1.425570
C -2.454718 -1.252008 0.174705
C -1.239336 1.805010 -0.985795
C -0.342961 -2.331570 -0.420531
C 4.607576 -0.680891 1.474412
C 4.978087 -1.090710 -0.907829
C -2.021451 3.408249 1.206459
C -3.160043 -2.413292 -0.213162
C -1.881946 3.040762 -1.208709
C -1.050774 -3.489423 -0.814548
C -2.278046 3.845988 -0.112317
C -2.460437 -3.537024 -0.710497
H -0.093990 -0.087954 1.662284
H 1.742210 1.944302 0.362974
H 2.107104 0.678892 1.586439
H 3.184789 0.658285 -1.298388
H 4.055174 1.506399 0.018553
H -1.169180 1.833957 2.450818
H -3.004446 -0.380423 0.548430
H -0.927483 1.177787 -1.828443
H 0.747059 -2.278987 -0.498136
H 3.842017 -0.449535 2.235214
H 5.451768 0.047022 1.602005
H 4.994242 -1.693128 1.688900
H 5.356547 -2.098480 -0.657849
H 5.863197 -0.410766 -1.014610
H 4.471506 -1.150546 -1.887227
H -2.321946 4.027665 2.059143
H -4.252824 -2.438615 -0.131687
H -2.077029 3.378525 -2.232977
H -0.501339 -4.355532 -1.201528
H -2.779413 4.804870 -0.286310
H -3.007413 -4.436759 -1.015036


