%chk=000211527.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211527

0 1
O 6.108334 -4.070990 0.230218
O 0.058196 -1.661094 -0.851050
N 4.298247 -1.885523 -0.082125
N 1.268950 0.263156 -0.714741
N 1.408637 1.586847 -0.513634
N -6.291195 -2.082940 0.190617
C 3.170409 -0.982981 0.311277
C 5.423290 -1.816325 0.907050
C 3.826987 -3.303671 -0.219712
C 2.539176 -0.474615 -1.002960
C 6.565475 -2.714482 0.403242
C 5.006353 -4.163969 -0.697285
C 0.027751 -0.464278 -0.623438
C -1.145793 0.367597 -0.278274
C 0.326835 2.306918 -0.227505
C -0.986407 1.710256 -0.106093
C -2.444939 -0.300011 -0.128985
C 0.503281 3.764593 -0.031054
C -2.807636 -1.379010 -0.957223
C -3.357433 0.131015 0.850677
C -4.972140 -1.552436 0.148482
C -4.046208 -1.995063 -0.827524
C -4.597736 -0.480899 0.995091
C -0.023820 4.380051 1.115949
C 1.188974 4.529532 -0.986979
C 0.129039 5.756580 1.296398
C 1.336457 5.906538 -0.798185
C -6.486965 -3.440740 -0.387872
C -7.041596 -1.915460 1.465502
C 0.806114 6.521396 0.340108
H 3.545603 -0.116597 0.897800
H 2.403371 -1.480892 0.943593
H 5.122208 -2.129161 1.929750
H 5.773344 -0.763848 0.968704
H 3.004454 -3.331803 -0.967451
H 3.417457 -3.717606 0.727252
H 2.291723 -1.326323 -1.681305
H 3.251024 0.188414 -1.544110
H 6.978571 -2.350240 -0.554061
H 7.368388 -2.827800 1.151960
H 4.771757 -5.242380 -0.679192
H 5.355723 -3.861831 -1.700168
H -1.832469 2.364866 0.112873
H -2.098482 -1.747382 -1.705283
H -3.089660 0.949493 1.519374
H -4.296765 -2.819315 -1.491971
H -5.280449 -0.118915 1.759968
H -0.541105 3.785920 1.867028
H 1.609314 4.047114 -1.869565
H -0.278195 6.234898 2.185828
H 1.867959 6.500333 -1.540556
H -6.142935 -3.448667 -1.437751
H -7.562290 -3.682609 -0.403191
H -5.956542 -4.235715 0.159631
H -7.092155 -0.843586 1.727216
H -6.600907 -2.463070 2.313348
H -8.080111 -2.259158 1.328539
H 0.921931 7.594169 0.483870


%chk=000211527-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211527

0 1
O 6.246735 -4.079082 -0.009604
O 0.165187 -1.789594 -0.761303
N 4.373925 -1.865184 -0.163008
N 1.278317 0.253909 -0.706163
N 1.421234 1.604032 -0.497550
N -6.277333 -2.255946 0.449475
C 3.250557 -0.979649 0.212946
C 5.495174 -1.856053 0.810484
C 3.939866 -3.262183 -0.432964
C 2.534592 -0.449165 -1.053876
C 6.662764 -2.692372 0.259598
C 5.124408 -4.082776 -0.965357
C 0.091820 -0.530377 -0.559049
C -1.113508 0.242009 -0.181344
C 0.303976 2.285393 -0.149979
C -0.959220 1.623647 -0.009702
C -2.415816 -0.428765 0.000322
C 0.474530 3.751942 0.055063
C -2.709442 -1.708262 -0.562642
C -3.464537 0.196711 0.741304
C -5.022611 -1.663805 0.306113
C -3.970652 -2.304959 -0.423640
C -4.726330 -0.390943 0.896919
C -0.499339 4.524929 0.743998
C 1.637210 4.409357 -0.434739
C -0.321276 5.913199 0.928855
C 1.815301 5.794411 -0.247358
C -6.537584 -3.578295 -0.136492
C -7.338790 -1.568909 1.197725
C 0.835334 6.556477 0.433057
H 3.645727 -0.117798 0.781889
H 2.505845 -1.499136 0.860997
H 5.187591 -2.271471 1.803197
H 5.831386 -0.813138 0.964184
H 3.122708 -3.260565 -1.176810
H 3.545506 -3.744532 0.496344
H 2.273160 -1.288429 -1.716303
H 3.180882 0.265199 -1.584394
H 7.039513 -2.226597 -0.676917
H 7.481818 -2.767637 0.994170
H 4.850458 -5.143292 -1.091518
H 5.460768 -3.663490 -1.938253
H -1.841440 2.234721 0.196113
H -1.922586 -2.234523 -1.107081
H -3.283516 1.154254 1.243124
H -4.136044 -3.282569 -0.884899
H -5.479672 0.130000 1.494398
H -1.392898 4.047430 1.160384
H 2.389685 3.814351 -0.960414
H -1.082413 6.490344 1.465806
H 2.715999 6.282981 -0.635784
H -6.423968 -3.568082 -1.239277
H -7.569225 -3.885619 0.095638
H -5.851945 -4.348362 0.270481
H -7.572583 -0.578403 0.758497
H -7.062866 -1.415510 2.261063
H -8.257324 -2.175617 1.170533
H 0.972342 7.634094 0.575846


