%chk=000178080.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178080

0 1
 O    1.076300      -1.548900       1.039500    
 O   -2.874500      -2.184100      -1.379600    
 O   -6.956500       1.169600     -8.9999998E-04
 O   -5.482500      0.6513000       1.696300    
 N    1.885700     -0.1658000     -0.7290000    
 N   -1.471900     -0.9456000     -4.9000001E-03
 N   -3.634400      -1.378800      0.6602000    
 N    8.139800       1.518300     -0.1210000    
 N    7.803500      0.1824000       1.766700    
 C  -0.3179000     -0.9743000     -0.8507000    
 C  -0.1848000      0.2498000      -1.737300    
 C    1.311200      0.3439000      -1.960900    
 C   0.9473000     -0.9396000     -1.2400000E-02
 C    3.249500      6.0100000E-02 -0.3762000    
 C   -2.676300      -1.559700     -0.3381000    
 C    3.774500     -0.5134000      0.7819000    
 C    4.058200      0.8534000      -1.190000    
 C    5.108100     -0.2936000       1.126200    
 C    5.391900       1.073400     -0.8456000    
 C    5.916800      0.4999000      0.3126000    
 C   -4.968200      -1.910400      0.5716000    
 C   -5.934700     -0.9379000     -9.2200004E-02
 C    7.307200      0.7299000      0.6715000    
 C   -6.068100      0.3688000      0.6602000    
 C   -7.200900       2.445500      0.5994000    
 C   -8.199500       3.205600     -0.2472000    
 H  -0.3068000      -1.892800      -1.449400    
 H  -0.7478000      0.1648000      -2.671700    
 H  -0.5420000       1.147100      -1.215100    
 H    1.586600       1.385300      -2.148200    
 H    1.636400     -0.2940000      -2.790000    
 H   -1.419600     -0.4378000      0.8732000    
 H    3.206400      -1.139100       1.456300    
 H    3.700300       1.310300      -2.106700    
 H    5.486300     -0.7548000       2.034600    
 H    5.977100       1.695200      -1.514100    
 H   -3.383000     -0.8403000       1.483400    
 H   -4.944900      -2.850500      9.9999998E-03
 H   -5.291500      -2.134500       1.593900    
 H   -6.925700      -1.401500     -0.1476000    
 H   -5.591400     -0.7087000      -1.107700    
 H    9.107900       1.665600      0.1455000    
 H    7.841600       1.974200     -0.9742000    
 H    8.788900      0.4572000       1.846200    
 H   -6.262000       3.007200      0.6582000    
 H   -7.603600       2.303200       1.608500    
 H   -8.410000       4.188400      0.1839000    
 H   -9.138000       2.647600     -0.3304000    
 H   -7.818500       3.340100      -1.265000    


%chk=000178080-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178080

0 1
O 0.963576 -0.766782 1.347759
O -2.652416 -1.968626 -1.838613
O -7.316308 1.391486 0.267801
O -5.529909 0.590867 1.522949
N 2.075549 -0.405194 -0.740970
N -1.416195 -0.910211 -0.162320
N -3.742566 -1.139856 0.069096
N 8.269622 1.578055 -0.103873
N 7.773649 0.811945 2.139295
C -0.155836 -1.214645 -0.825249
C 0.139442 -0.477644 -2.150154
C 1.686275 -0.439809 -2.183567
C 1.009925 -0.779572 0.083892
C 3.399407 -0.070579 -0.330628
C -2.613403 -1.378982 -0.707266
C 3.731740 0.124824 1.042006
C 4.419805 0.069512 -1.310205
C 5.044321 0.469251 1.403122
C 5.730726 0.419109 -0.930239
C 6.063663 0.636165 0.430425
C -5.074716 -1.551248 -0.377538
C -5.989194 -0.352535 -0.721612
C 7.440338 1.021133 0.879430
C -6.222806 0.559371 0.472537
C -7.622696 2.371664 1.361405
C -8.840425 3.168767 0.907685
H -0.071535 -2.309512 -1.003779
H -0.300789 -0.991098 -3.016852
H -0.274067 0.544616 -2.094427
H 2.072899 0.455647 -2.699254
H 2.112476 -1.337823 -2.672551
H -1.341488 -0.658357 0.829524
H 2.958654 0.002253 1.802436
H 4.208423 -0.117218 -2.366936
H 5.316245 0.614303 2.452956
H 6.499831 0.470378 -1.709812
H -3.704911 -0.576908 0.922858
H -4.930896 -2.173069 -1.277207
H -5.555762 -2.172516 0.402036
H -6.966736 -0.698522 -1.103784
H -5.527162 0.247263 -1.529551
H 9.231696 1.822347 0.120959
H 7.900060 1.882330 -1.001505
H 8.734343 1.138238 2.373027
H -6.730636 3.005120 1.515510
H -7.806218 1.803169 2.290709
H -9.109024 3.911118 1.681165
H -9.708070 2.506834 0.745705
H -8.632399 3.706938 -0.032694


