%chk=000149905.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149905

0 1
 O   0.3284000      -2.205800     -0.4765000    
 O   0.6840000       2.443200     -0.6736000    
 O   -5.860700      -1.687900     -5.4299999E-02
 N   0.4603000      0.1201000     -0.6504000    
 N   -6.591900      0.8347000       1.778800    
 N   -7.323700     -0.2280000      -1.052300    
 C   -1.885300      0.3583000      0.1288000    
 C  -0.9378000      0.2115000      -1.057700    
 C   -3.355100      0.4336000     -0.2999000    
 C   -4.281800      0.5200000      0.9210000    
 C    3.172700     -6.0600001E-02  3.0500000E-02
 C    2.418500      -1.237500     -7.5700000E-02
 C    2.607400       1.205300     -0.1769000    
 C   0.9807000      -1.165800     -0.4188000    
 C    1.174100       1.326000     -0.5226000    
 C   -5.774200      0.6596000      0.5805000    
 C    4.548200     -0.1531000      0.3603000    
 C    3.010600      -2.488500      0.1399000    
 C    3.385200       2.364300     -6.1299998E-02
 C    5.126600      -1.413500      0.5721000    
 C    5.314200       1.017100      0.4714000    
 C    4.361800      -2.572800      0.4625000    
 C    4.735300       2.266800      0.2618000    
 C   -6.297600     -0.5470000     -0.1877000    
 H   -1.624300       1.257800      0.7000000    
 H   -1.747800     -0.4910000      0.8101000    
 H   -1.204500     -0.6835000      -1.632400    
 H   -1.060000       1.067900      -1.731700    
 H   -3.505700       1.312500     -0.9380000    
 H   -3.602000     -0.4492000     -0.9000000    
 H   -4.125700     -0.3695000       1.546200    
 H   -3.976100       1.382600       1.528000    
 H   -5.899000       1.551700     -4.5800000E-02
 H    2.436900      -3.407900      6.0300000E-02
 H    2.958400       3.350900     -0.2203000    
 H    6.180800      -1.504000      0.8258000    
 H    6.371400      0.9656000      0.7235000    
 H    4.820800      -3.543000      0.6291000    
 H    5.338600       3.165600      0.3510000    
 H   -6.274000       1.658100       2.289100    
 H   -6.448100      4.6700001E-02   2.410000    
 H   -7.762500     -0.9416000      -1.624800    
 H   -7.683400      0.7163000      -1.147300    


%chk=000149905-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149905

0 1
O 0.416791 -2.239834 -0.845265
O 0.634201 2.423251 -0.637092
O -5.809641 -1.430725 -0.912303
N 0.548672 0.092277 -0.763725
N -6.634934 1.344059 1.352538
N -7.791545 -0.618148 0.017714
C -1.848567 0.239471 0.004768
C -0.875653 0.181455 -1.193349
C -3.310794 0.375584 -0.472931
C -4.299338 0.511258 0.707678
C 3.271999 -0.073682 0.076645
C 2.536306 -1.273478 -0.183136
C 2.652750 1.208074 -0.072195
C 1.112362 -1.206761 -0.613594
C 1.230772 1.312454 -0.501514
C -5.777903 0.748636 0.286368
C 4.651696 -0.157536 0.493174
C 3.152832 -2.524985 -0.032634
C 3.383532 2.377836 0.186460
C 5.251947 -1.451157 0.635757
C 5.369941 1.056313 0.747721
C 4.514340 -2.612741 0.377203
C 4.745553 2.300340 0.596630
C -6.445754 -0.548049 -0.259681
H -1.579087 1.100745 0.646986
H -1.736238 -0.681784 0.608466
H -1.086500 -0.707685 -1.809430
H -0.974339 1.095764 -1.802075
H -3.398778 1.273010 -1.122629
H -3.604106 -0.498299 -1.081152
H -4.242097 -0.396076 1.342570
H -3.990996 1.372078 1.337242
H -5.781913 1.465094 -0.560968
H 2.562194 -3.423662 -0.238313
H 2.881244 3.342941 0.063752
H 6.299749 -1.518638 0.951193
H 6.418252 0.997562 1.063343
H 4.981639 -3.596345 0.488940
H 5.302840 3.221833 0.793354
H -6.533485 2.362265 1.425880
H -6.484037 0.900186 2.268196
H -8.342515 -1.405540 -0.319180
H -8.177692 0.148637 0.581289


