%chk=000208495.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208495

0 1
O -0.171493 -2.177539 1.284593
O -2.969812 -0.612740 1.071944
O -0.854284 -1.946129 -0.862040
N 5.773230 -0.053121 -0.651275
N 3.209715 -0.918199 0.404872
C 5.047850 -1.231158 -1.233184
C 5.452775 0.056474 0.809954
C 3.529145 -1.032737 -1.056888
C 3.934506 0.257607 0.989707
C 7.252028 -0.178328 -0.875068
C 1.733516 -0.813245 0.624749
C 7.905033 1.206732 -0.717782
C 1.233165 -2.241124 0.879021
C 9.393680 1.157081 -1.047520
C -4.460510 1.581355 1.749237
C -4.419186 1.069096 0.325121
C -1.120445 -2.001269 0.313821
C -3.655121 -0.070550 -0.017798
C -2.488810 -1.960781 0.987463
C -5.900784 1.604069 2.278172
C -3.812167 2.969284 1.837390
C -5.119242 1.696491 -0.708569
C -3.581784 -0.567075 -1.316975
C -4.301355 0.085863 -2.332902
C -5.071481 1.213844 -2.021421
C -4.232940 -0.434361 -3.731459
H 5.282907 -1.284214 -2.317712
H 5.354750 -2.197086 -0.776489
H 5.783616 -0.831374 1.392107
H 5.989531 0.939506 1.218835
H 2.990585 -1.913493 -1.466221
H 3.199779 -0.143938 -1.639725
H 3.629410 1.223352 0.530333
H 3.698125 0.310905 2.073600
H 7.736191 -0.912620 -0.197329
H 7.423635 -0.544606 -1.910965
H 1.178983 -0.360603 -0.227247
H 1.500302 -0.181157 1.508887
H 7.756126 1.585456 0.311993
H 7.387876 1.932428 -1.378491
H 1.326505 -2.893718 -0.004221
H 1.699489 -2.708625 1.765002
H 9.855282 2.144401 -0.929335
H 9.569711 0.838580 -2.081465
H 9.933229 0.463741 -0.392698
H -3.866727 0.881250 2.397988
H -3.201277 -2.621989 0.460263
H -2.419380 -2.241719 2.062398
H -6.371194 0.619298 2.179581
H -5.926783 1.881600 3.336994
H -6.525859 2.321022 1.736118
H -4.363957 3.716445 1.257898
H -2.786835 2.947465 1.449978
H -3.769526 3.320426 2.873344
H -5.718408 2.580351 -0.486321
H -2.949749 -1.419460 -1.565537
H -5.632407 1.723749 -2.799965
H -3.190255 -0.556819 -4.061435
H -4.712707 -1.420687 -3.809866
H -4.725399 0.225596 -4.456562


%chk=000208495-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208495

0 1
O -0.813633 -1.811470 1.476744
O -3.518269 -1.414043 1.005265
O -0.746118 -3.439678 -0.198602
N 5.158609 -0.064684 -0.839580
N 2.536511 -0.483689 0.337856
C 4.632944 -1.430516 -0.586956
C 4.595265 0.886160 0.150986
C 3.098223 -1.437050 -0.652721
C 3.058579 0.883328 0.092079
C 6.642116 -0.044191 -0.894171
C 1.063777 -0.555634 0.443463
C 7.222812 1.259140 -1.481996
C 0.676367 -1.676318 1.427016
C 8.755380 1.176210 -1.653380
C -4.414898 1.059271 1.909574
C -3.938514 0.881045 0.465906
C -1.387405 -2.691299 0.575941
C -3.445859 -0.385322 0.031027
C -2.920121 -2.700415 0.686482
C -5.358025 2.266495 2.109088
C -3.188735 1.158001 2.864044
C -3.911168 1.929146 -0.479396
C -2.946227 -0.585211 -1.273742
C -2.923297 0.486154 -2.205886
C -3.412480 1.745059 -1.791808
C -2.397543 0.262677 -3.614167
H 5.035110 -2.111593 -1.360269
H 4.951105 -1.816712 0.415289
H 4.916965 0.625457 1.192577
H 4.957846 1.904447 -0.074353
H 2.724176 -2.454207 -0.437083
H 2.780184 -1.169368 -1.691309
H 2.739633 1.273156 -0.906628
H 2.661102 1.560800 0.870436
H 7.094848 -0.225920 0.117258
H 6.958818 -0.887991 -1.539107
H 0.570615 -0.737170 -0.541189
H 0.677392 0.405471 0.827375
H 6.978700 2.119456 -0.828982
H 6.735672 1.448625 -2.457353
H 1.112520 -2.645549 1.130788
H 0.967001 -1.420280 2.456011
H 9.163677 2.118760 -2.060726
H 9.035390 0.360138 -2.346025
H 9.256020 0.982129 -0.685661
H -4.966591 0.140200 2.187995
H -3.322244 -3.131549 -0.249288
H -3.205362 -3.355302 1.528303
H -6.220301 2.231638 1.418098
H -5.747472 2.271213 3.143651
H -4.830612 3.226965 1.954897
H -2.600303 2.068698 2.642754
H -2.531196 0.279037 2.750535
H -3.522598 1.211591 3.917562
H -4.287474 2.915580 -0.189137
H -2.572127 -1.563955 -1.594338
H -3.406650 2.586110 -2.494883
H -1.399039 -0.212964 -3.604845
H -3.067796 -0.401802 -4.192633
H -2.314501 1.214726 -4.165886


