%chk=000115083.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115083

0 1
 O    8.272200       1.715400     -9.4300002E-02
 N    7.211800     -8.9800000E-02  0.1598000    
 N    7.270600       1.081500     -0.4472000    
 C   -1.606800     -0.5686000     -1.4000000E-02
 C  -0.3179000      0.1920000      0.3016000    
 C   -2.841000      0.2985000      0.2403000    
 C   0.9174000     -0.6636000      1.5900001E-02
 C   -4.128600     -0.4507000     -0.1069000    
 C    2.207600      0.1091000      0.3000000    
 C   -5.364900      0.4051000      0.1791000    
 C    3.441700     -0.7386000     -1.7000001E-02
 C   -6.649900     -0.3342000     -0.2002000    
 C    4.764200     -8.6000003E-03  0.2382000    
 C   -7.919400      0.4865000      4.4300001E-02
 C    5.993900     -0.8483000     -0.1056000    
 C   -9.204900     -0.2614000     -0.3111000    
 C   -10.43520      0.5907000     -3.8600001E-02
 C    8.389200     -0.9147000     -0.1445000    
 H   -1.659700      -1.475000      0.6013000    
 H   -1.595200     -0.8899000      -1.062700    
 H  -0.2762000       1.107600     -0.3009000    
 H  -0.3187000      0.4978000       1.354900    
 H   -2.863900      0.6023000       1.293900    
 H   -2.778000       1.214700     -0.3592000    
 H   0.9062000     -0.9842000      -1.033000    
 H   0.8877000      -1.570700      0.6318000    
 H   -4.183500      -1.378800      0.4751000    
 H   -4.112900     -0.7337000      -1.166500    
 H    2.232000      0.4135000       1.353200    
 H    2.229300       1.024900     -0.3028000    
 H   -5.303100       1.342500     -0.3867000    
 H   -5.393900      0.6699000       1.242800    
 H    3.403900      -1.050800      -1.068200    
 H    3.416600      -1.654600      0.5862000    
 H   -6.607100     -0.6161000      -1.259700    
 H   -6.711100      -1.267700      0.3730000    
 H    4.741700      0.9156000     -0.3529000    
 H    4.804700      0.2894000       1.294200    
 H   -7.954500      0.7823000       1.100300    
 H   -7.865100       1.412500     -0.5415000    
 H    5.977600      -1.757600      0.5088000    
 H    5.941100      -1.162900      -1.157100    
 H   -9.269700      -1.186600      0.2731000    
 H   -9.188100     -0.5456000      -1.369600    
 H   -10.41450       1.510600     -0.6316000    
 H   -11.34350      3.8699999E-02 -0.2995000    
 H   -10.49630      0.8648000       1.019500    
 H    8.476900      -1.134700      -1.216200    
 H    8.333100      -1.870500      0.3909000    
 H    9.323400     -0.4463000      0.1901000    


%chk=000115083-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115083

0 1
O 8.531723 1.640265 0.647673
N 7.378017 -0.228983 0.130538
N 7.369445 1.119200 0.455047
C -1.619122 -0.521406 -0.192248
C -0.299035 0.233067 0.083551
C -2.880687 0.323999 0.093338
C 0.960537 -0.620543 -0.185563
C -4.199662 -0.432327 -0.182965
C 2.281003 0.134151 0.086648
C -5.462882 0.407237 0.112641
C 3.537300 -0.732040 -0.156333
C -6.780723 -0.351954 -0.161971
C 4.851880 0.036280 0.108505
C -8.045517 0.483314 0.139131
C 6.071854 -0.878626 -0.109036
C -9.362348 -0.279469 -0.132764
C -10.621378 0.561259 0.170846
C 8.616993 -1.014543 0.007994
H -1.649289 -1.443236 0.426061
H -1.634910 -0.857237 -1.250485
H -0.262916 1.149066 -0.542656
H -0.288476 0.578283 1.138699
H -2.865424 0.658114 1.152079
H -2.851574 1.246798 -0.523324
H 0.948080 -0.970091 -1.239394
H 0.923999 -1.533917 0.444925
H -4.224794 -1.358582 0.428892
H -4.218056 -0.760881 -1.243455
H 2.285723 0.498852 1.134839
H 2.327214 1.037402 -0.556446
H -5.439456 1.333354 -0.499319
H -5.444205 0.735997 1.173027
H 3.525370 -1.104932 -1.202285
H 3.489409 -1.629583 0.496130
H -6.801148 -0.677724 -1.223327
H -6.801607 -1.279973 0.447419
H 4.918418 0.916925 -0.555764
H 4.860741 0.429500 1.141790
H -8.025921 0.810619 1.200008
H -8.028230 1.410580 -0.471435
H 6.001158 -1.759384 0.563504
H 6.065739 -1.269400 -1.148851
H -9.378481 -1.205576 0.477736
H -9.381080 -0.606364 -1.192687
H -10.645373 1.477131 -0.449692
H -11.548109 -0.007300 -0.030393
H -10.641352 0.875832 1.231569
H 8.701321 -1.448322 -1.005245
H 8.633174 -1.833023 0.751159
H 9.461855 -0.330109 0.192691


