%chk=000174258.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174258

1 1
 O   -7.975800      0.5662000      0.2807000    
 N    1.887500      -5.236900     -4.7800001E-02
 N    4.342800       3.977400     -6.1000001E-02
 N   -5.197700       1.140200      0.2933000    
 C   0.3340000     -8.5000005E-03  6.0600001E-02
 C   0.7165000      -1.295900      3.3399999E-02
 C    1.387800       1.039300      2.8600000E-02
 C   -1.120400      0.2935000      0.1218000    
 C    2.129500      -1.638300     -2.6500000E-02
 C  -0.2797000      -2.356000      6.4099997E-02
 C    1.907800       1.496500       1.221300    
 C    1.811200       1.520100      -1.192700    
 C   -1.819300      0.4404000      -1.057700    
 C   -1.722800      0.4168000       1.356100    
 C    1.521800      -4.006400     -2.2000000E-02
 C    3.343000       2.983300     -3.0800000E-02
 C   -3.818100      0.8537000      0.2353000    
 C    2.532300      -2.916200     -5.3500000E-02
 C   8.0399998E-02  -3.646600      3.9000001E-02
 C    2.896600       2.479900       1.191300    
 C    2.800200       2.503400      -1.222800    
 C   -3.183900      0.7239000      -1.000400    
 C   -3.087500      0.7001000       1.413700    
 C   -6.005700       1.309900     -0.8746000    
 C   0.8958000      -6.342600     -1.7300000E-02
 C    3.321500      -5.619800     -0.1098000    
 C    4.466400       4.927600       1.026500    
 C    5.268900       4.053400      -1.173500    
 C   -7.433400       1.641700     -0.4753000    
 H    2.910700     -0.8878000     -5.1700000E-02
 H   -1.343500      -2.154800      0.1082000    
 H    1.569800       1.109600       2.178500    
 H    1.393800       1.155300      -2.127000    
 H   -1.335700      0.3408000      -2.025400    
 H   -1.163800      0.2991000       2.280100    
 H    3.594200      -3.124800     -9.8099999E-02
 H  -0.6948000      -4.402400      6.3600004E-02
 H    3.306800       2.823000       2.136800    
 H    3.117000       2.882600      -2.190200    
 H   -3.714300      0.8340000      -1.941400    
 H   -3.569600      0.7986000       2.382900    
 H   -5.619100       1.214800       1.212800    
 H   -5.622800       2.124400      -1.500000    
 H   -6.010900      0.3833000      -1.461000    
 H   0.2524000      -6.268000     -0.8987000    
 H   0.3250000      -6.283200      0.9138000    
 H    1.411000      -7.306600     -4.5899998E-02
 H    3.830300      -5.239800      0.7809000    
 H    3.756500      -5.222900      -1.031600    
 H    3.416600      -6.709000     -0.1238000    
 H    5.033500       5.812100      0.7153000    
 H    4.994100       4.479700       1.875000    
 H    3.485900       5.284600       1.361200    
 H    5.613900       3.058400      -1.476700    
 H    4.803900       4.548900      -2.032100    
 H    6.162500       4.628300     -0.9057000    
 H   -8.053200       1.787700      -1.365400    
 H   -7.471900       2.549200      0.1366000    
 H   -8.887300      0.8125000      0.5129000    


%chk=000174258-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000174258

1 1
O -7.694204 2.187994 0.092199
N 1.969202 -5.513933 0.057933
N 4.299141 4.137166 0.371277
N -5.192945 1.368296 -0.329110
C 0.345145 -0.009310 0.033180
C 0.757571 -1.408281 0.037997
C 1.348219 1.045746 0.122596
C -1.068210 0.333862 -0.060917
C 2.007814 -1.829411 -0.528879
C -0.065460 -2.435867 0.611181
C 2.573703 0.863458 0.848313
C 1.162735 2.319680 -0.513366
C -1.994635 -0.486867 -0.789184
C -1.604047 1.509251 0.573129
C 1.577829 -4.188451 0.050573
C 3.346089 3.139219 0.291701
C -3.870899 1.008703 -0.250083
C 2.403563 -3.166935 -0.539446
C 0.328133 -3.773888 0.633336
C 3.534281 1.870220 0.945765
C 2.125066 3.327268 -0.448194
C -3.348414 -0.162229 -0.897167
C -2.956851 1.829887 0.498178
C -6.262500 0.603254 -0.982011
C 1.088355 -6.550907 0.630520
C 3.273992 -5.911891 -0.506002
C 5.566938 3.905814 1.090878
C 4.064773 5.448205 -0.265464
C -7.462304 1.532991 -1.206781
H 2.645292 -1.084657 -1.016941
H -1.006033 -2.152197 1.095140
H 2.734602 -0.075725 1.388058
H 0.262666 2.485300 -1.114776
H -1.616916 -1.368609 -1.317553
H -0.939049 2.137260 1.175022
H 3.345788 -3.434592 -1.023948
H -0.319174 -4.505781 1.122557
H 4.427868 1.690072 1.548400
H 1.949009 4.260657 -0.988464
H -4.008097 -0.807597 -1.484400
H -3.340403 2.712242 1.023796
H -5.543042 2.143400 0.246102
H -5.923127 0.212224 -1.958545
H -6.569573 -0.256369 -0.351680
H 0.104120 -6.567187 0.125565
H 0.924556 -6.392363 1.713925
H 1.553960 -7.538295 0.497791
H 4.106724 -5.381564 -0.006841
H 3.326914 -5.706012 -1.592488
H 3.421677 -6.991341 -0.356627
H 6.214069 4.788261 0.981829
H 6.108739 3.033215 0.680219
H 5.396622 3.737462 2.171801
H 3.988704 5.358038 -1.366353
H 3.138269 5.918912 0.113504
H 4.904350 6.120391 -0.035852
H -8.338418 0.936146 -1.526487
H -7.224899 2.286621 -1.985091
H -8.486577 2.776745 0.054081


