%chk=000246810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246810

0 1
O -1.365070 -0.076024 -1.522696
O -0.814706 0.563500 0.615095
N 4.298483 -1.254033 0.070480
N 0.010614 1.685089 -1.265442
C 2.670435 0.579659 -0.255124
C 2.452446 1.992416 -0.804914
C 4.160844 0.195750 -0.286977
C 1.022102 2.507012 -0.537609
C 5.558463 -1.841150 -0.470615
C 4.137605 -1.473983 1.545507
C 0.869598 3.961785 -0.992814
C -4.703554 -1.403973 -0.309697
C -3.608854 -0.377687 -0.619894
C -6.016172 -0.713475 0.084145
C 6.869069 -1.231310 0.036939
C 3.845471 -2.947738 1.832064
C -2.302198 -1.067591 -0.997938
C -0.710637 0.713073 -0.586087
C -7.117895 -1.736651 0.394039
C -8.426462 -1.054367 0.786496
H 2.277004 0.498214 0.778637
H 2.088988 -0.160973 -0.841982
H 2.676011 2.014731 -1.888347
H 3.171585 2.695539 -0.339735
H 4.558378 0.346684 -1.314293
H 4.745630 0.864386 0.379252
H 0.795307 2.431153 0.563308
H 5.539980 -2.930839 -0.242134
H 5.509434 -1.760619 -1.579695
H 5.022148 -1.139387 2.129279
H 3.274453 -0.859989 1.892620
H -0.161466 4.313903 -0.851498
H 1.521602 4.625159 -0.413367
H 1.115174 4.099403 -2.051364
H 0.073702 1.640119 -2.279707
H -4.871906 -2.057042 -1.187955
H -4.371941 -2.072115 0.509658
H -3.926413 0.296170 -1.440011
H -3.436306 0.281477 0.257676
H -5.850348 -0.062613 0.964722
H -6.347897 -0.038881 -0.728414
H 7.733300 -1.756987 -0.382966
H 6.947627 -1.295188 1.128206
H 6.963527 -0.176100 -0.237805
H 3.524414 -3.088292 2.869122
H 4.722044 -3.581569 1.661826
H 3.043525 -3.320352 1.179817
H -2.395539 -1.740983 -1.868878
H -1.831405 -1.588214 -0.145406
H -7.285701 -2.388309 -0.485644
H -6.788219 -2.408963 1.210399
H -8.303884 -0.429673 1.678778
H -8.801879 -0.408736 -0.015519
H -9.206709 -1.791314 1.007061


%chk=000246810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246810

0 1
O -1.559257 -0.248191 -1.462216
O -1.078581 0.425509 0.754041
N 4.702867 -1.246536 0.091561
N 0.066025 1.297094 -1.110669
C 2.816375 0.431823 -0.104301
C 2.448131 1.849196 -0.594593
C 4.325947 0.144325 -0.265172
C 0.957788 2.219238 -0.378902
C 5.927835 -1.719316 -0.603852
C 4.683043 -1.490497 1.556607
C 0.666639 3.683087 -0.782107
C -5.099906 -1.296322 -0.299484
C -3.955460 -0.367590 -0.768277
C -6.440229 -0.548372 -0.117189
C 7.267005 -1.037338 -0.202398
C 4.826957 -2.976896 1.933487
C -2.635480 -1.131595 -0.939271
C -0.864450 0.500463 -0.485736
C -7.592194 -1.467318 0.349633
C -8.926821 -0.712801 0.533221
H 2.511104 0.328869 0.955470
H 2.250914 -0.330970 -0.670770
H 2.697561 1.953331 -1.672870
H 3.064598 2.601371 -0.060635
H 4.597310 0.300313 -1.328809
H 4.903396 0.904466 0.324095
H 0.705789 2.078426 0.688544
H 6.016368 -2.810108 -0.447081
H 5.761751 -1.577291 -1.689488
H 5.468538 -0.894357 2.090210
H 3.709977 -1.130378 1.937288
H -0.392241 3.935545 -0.598767
H 1.296897 4.378760 -0.198760
H 0.882342 3.851016 -1.854972
H 0.117972 1.248678 -2.129910
H -5.237802 -2.118882 -1.032587
H -4.817265 -1.775435 0.660931
H -4.228972 0.107316 -1.730973
H -3.805931 0.441677 -0.028684
H -6.304402 0.271289 0.618496
H -6.724332 -0.063472 -1.074607
H 8.099658 -1.456326 -0.797936
H 7.502907 -1.199682 0.865265
H 7.235892 0.052632 -0.383827
H 4.665125 -3.108144 3.019134
H 5.830356 -3.374773 1.697272
H 4.077262 -3.581240 1.392473
H -2.719171 -1.924259 -1.702149
H -2.304318 -1.564041 0.022566
H -7.726742 -2.285817 -0.386962
H -7.305938 -1.952838 1.304962
H -8.827369 0.089519 1.288514
H -9.249537 -0.241826 -0.414619
H -9.734132 -1.391229 0.865402


