%chk=000153224.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153224

0 1
 O    5.058400      0.5537000     -0.8507000    
 N   -1.107800      0.4396000      0.4654000    
 N   -3.998800       2.533900     -0.5882000    
 N   -1.264100      -1.836700       1.151000    
 C   -1.805800       1.519700     -0.2308000    
 C  -9.3599997E-02  0.7878000       1.436900    
 C   -3.297300       1.462700      6.5099999E-02
 C    1.268200      0.7261000      0.8327000    
 C   -1.414000     -0.8965000      0.1799000    
 C    1.815200       1.857800      0.2282000    
 C    1.994700     -0.4641000      0.8713000    
 C   -1.863100      -1.201000      -1.103300    
 C    3.088800       1.799500     -0.3377000    
 C    3.268400     -0.5223000      0.3055000    
 C    3.815400      0.6094000     -0.2990000    
 C   -5.440300       2.462200     -0.3455000    
 C   -2.171200      -2.523500      -1.402100    
 C   -1.573300      -3.111400      0.8236000    
 C   -2.026300      -3.503000     -0.4259000    
 C    5.746500     -0.6940000     -0.7763000    
 H   -1.597100       1.500000      -1.307000    
 H   -1.422100       2.491700      0.1076000    
 H  -0.1464000      0.1377000       2.320400    
 H  -0.2701000       1.793100       1.842700    
 H   -3.443300       1.529100       1.151200    
 H   -3.725600      0.5054000     -0.2499000    
 H    1.259900       2.791200      0.1903000    
 H    1.584700      -1.352500       1.343700    
 H   -3.828900       2.501500      -1.593100    
 H   -1.966100     -0.4698000      -1.896100    
 H    3.509600       2.684300     -0.8074000    
 H    3.778000      -1.477400      0.3717000    
 H   -5.664100       2.530900      0.7239000    
 H   -5.867600       1.536600     -0.7448000    
 H   -5.933300       3.303900     -0.8416000    
 H   -2.518400      -2.792100      -2.395400    
 H   -1.442300      -3.837000       1.619500    
 H   -2.259100      -4.540400     -0.6369000    
 H    5.218400      -1.478300      -1.329200    
 H    5.947600     -0.9813000      0.2614000    
 H    6.717200     -0.5574000      -1.264000    


%chk=000153224-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153224

0 1
O 5.026215 1.392609 -0.431664
N -1.255180 -0.171037 0.325396
N -3.366893 2.653461 -1.086342
N -1.104818 -2.416107 1.038323
C -1.697068 0.890399 -0.591077
C -0.319043 0.223570 1.409645
C -3.027194 1.557097 -0.160332
C 1.095841 0.510369 0.917720
C -1.676864 -1.490816 0.191576
C 1.642439 1.818872 0.968928
C 1.900155 -0.533532 0.398129
C -2.657093 -1.888125 -0.780094
C 2.949341 2.082650 0.514981
C 3.211978 -0.289348 -0.063218
C 3.737683 1.027026 -0.004118
C -4.535138 3.461163 -0.688250
C -3.013701 -3.243691 -0.870340
C -1.483784 -3.718131 0.936600
C -2.424161 -4.196010 -0.000351
C 5.881500 0.336910 -0.976692
H -1.787414 0.489119 -1.620058
H -0.913603 1.667727 -0.630387
H -0.313297 -0.609161 2.132060
H -0.729088 1.123447 1.909556
H -2.898839 1.989695 0.851379
H -3.827519 0.779886 -0.073343
H 1.040093 2.642441 1.373204
H 1.489289 -1.549023 0.361759
H -3.439240 2.323353 -2.058128
H -3.135250 -1.155686 -1.435018
H 3.378034 3.088817 0.551230
H 3.808423 -1.118732 -0.455578
H -4.319516 3.972475 0.268288
H -5.476685 2.875222 -0.549715
H -4.723315 4.241400 -1.446880
H -3.758845 -3.556884 -1.610551
H -0.998601 -4.403196 1.642930
H -2.684695 -5.256961 -0.043352
H 5.432728 -0.121069 -1.879995
H 6.081678 -0.450591 -0.223871
H 6.822448 0.839494 -1.245252


