%chk=000160545.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160545

0 1
 O  -0.8674000      0.4654000      -2.387600    
 N  -6.5300003E-02 -4.2300001E-02  0.4535000    
 N    4.283000      1.7100001E-02 -0.1237000    
 C   -1.955100      0.9040000      -1.580200    
 C   -2.776900     -0.2681000      -1.055600    
 C    1.381000     -0.1543000      0.6987000    
 C  -0.5586000       1.285700      0.5011000    
 C  -0.8155000      -1.245000      0.3715000    
 C   -1.467100       1.772500     -0.4541000    
 C   -2.068200      -1.357100     -0.2757000    
 C    2.045600      -1.019100     -0.3719000    
 C    3.547700      -1.240900     -0.1704000    
 C  -0.1371000       2.168700       1.520200    
 C  -0.3236000      -2.414800       1.010900    
 C   -1.927400       3.100900     -0.3746000    
 C   -2.771400      -2.587400     -0.2291000    
 C  -0.6002000       3.483400       1.590500    
 C   -1.496800       3.950400      0.6408000    
 C   -1.024000      -3.623000       1.028600    
 C   -2.256500      -3.708500      0.4106000    
 C    4.161200      0.7332000      -1.394900    
 C    5.692700     -0.2208000      0.1917000    
 H   -2.600800       1.498600      -2.238500    
 H   -3.229100     -0.7453000      -1.936800    
 H   -3.601400      0.1068000     -0.4342000    
 H    1.864000      0.8299000      0.6479000    
 H    1.583200     -0.5279000       1.710100    
 H    1.846000     -0.5886000      -1.361400    
 H    1.612600      -2.020400     -0.4362000    
 H    3.927800      -1.894500     -0.9667000    
 H    3.681900      -1.781700      0.7753000    
 H   0.5473000       1.830800       2.296200    
 H   0.6082000      -2.409900       1.571700    
 H   -2.629800       3.483800      -1.111500    
 H   -3.743000      -2.674500     -0.7135000    
 H  -0.2623000       4.136300       2.389800    
 H   -1.862000       4.971600      0.6891000    
 H  -0.6086000      -4.484600       1.542700    
 H   -2.816900      -4.637800      0.4246000    
 H   -1.231100     -0.1050000      -3.086200    
 H    4.796200       1.627500      -1.389200    
 H    3.145800       1.104900      -1.561600    
 H    4.460300      0.1172000      -2.250800    
 H    6.234200      0.7280000      0.2763000    
 H    6.188500     -0.8353000     -0.5686000    
 H    5.791200     -0.7233000       1.160300    


%chk=000160545-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160545

0 1
O -0.832030 0.633082 -2.509493
N -0.017254 -0.043441 0.081634
N 4.376076 -0.012621 -0.300263
C -2.002192 0.972512 -1.678765
C -2.803871 -0.290617 -1.298183
C 1.444081 -0.181859 0.341618
C -0.600604 1.251396 0.409830
C -0.872519 -1.204044 0.272066
C -1.602479 1.776049 -0.449357
C -2.163725 -1.302423 -0.339485
C 2.128656 -1.116398 -0.677504
C 3.632011 -1.294354 -0.379829
C -0.170700 1.993793 1.534761
C -0.411970 -2.279243 1.084018
C -2.174799 3.032280 -0.154079
C -2.936920 -2.464303 -0.078164
C -0.746004 3.253768 1.814792
C -1.756274 3.774003 0.974528
C -1.196271 -3.425780 1.312895
C -2.480015 -3.521154 0.733004
C 4.432033 0.708511 -1.589494
C 5.722306 -0.195554 0.280133
H -2.631868 1.594732 -2.338827
H -3.041431 -0.819380 -2.242530
H -3.772438 0.036569 -0.867203
H 1.891718 0.821049 0.250959
H 1.666095 -0.523957 1.376556
H 1.978984 -0.712285 -1.697236
H 1.656349 -2.116400 -0.667549
H 4.071883 -1.979137 -1.152100
H 3.746858 -1.802344 0.598654
H 0.601399 1.587523 2.196516
H 0.569090 -2.213246 1.562515
H -2.939140 3.441351 -0.826205
H -3.926529 -2.537583 -0.547471
H -0.409387 3.821751 2.689269
H -2.203655 4.750548 1.189094
H -0.809066 -4.230796 1.947475
H -3.108022 -4.402233 0.901813
H -0.188107 0.200762 -1.870680
H 4.972003 1.662153 -1.452815
H 3.415687 0.949187 -1.945411
H 4.950688 0.127251 -2.394283
H 6.213224 0.787054 0.398611
H 6.391924 -0.841012 -0.344509
H 5.638504 -0.658561 1.279792


