%chk=000209363.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209363

0 1
O 1.787222 0.779854 2.816791
O 3.251540 -2.382689 -1.228202
N 0.771409 -0.926041 1.720456
N 4.292546 -0.379129 -0.951528
C -1.627548 -0.246280 1.300888
C -1.607842 -1.240129 0.159125
C -0.541776 -0.615777 2.341423
C -1.605323 1.189258 0.797538
C -0.491712 -2.039255 -0.122133
C -2.768519 -1.379272 -0.630928
C 0.755117 -2.022774 0.725154
C -3.956792 -0.516329 -0.318154
C -2.553708 1.680487 -0.124537
C -3.694748 0.924671 -0.763426
C -0.520809 -2.936542 -1.204473
C -2.797940 -2.284143 -1.695654
C 1.874876 -0.120314 1.986451
C -0.646140 2.084547 1.304714
C -1.668001 -3.056885 -1.985451
C -2.477537 3.028505 -0.537698
C 3.185253 -0.412611 1.281959
C -0.584042 3.414308 0.893368
C -1.503729 3.891385 -0.043659
C 3.177402 0.168143 -0.142125
C 5.519162 0.436580 -1.061375
C 4.234867 -1.682287 -1.438452
H -2.612342 -0.361393 1.845610
H -0.411629 0.205317 3.089274
H -0.876565 -1.515999 2.905981
H 0.832023 -2.995138 1.273344
H 1.657220 -1.976504 0.053524
H -4.869906 -0.895170 -0.820086
H -4.185853 -0.550580 0.769122
H -3.521634 0.920489 -1.865032
H -4.629669 1.508015 -0.608265
H 0.361787 -3.533841 -1.436209
H -3.693476 -2.385619 -2.303933
H 0.079545 1.752960 2.058548
H -1.686403 -3.752607 -2.822590
H -3.199126 3.408293 -1.260182
H 3.394983 -1.503203 1.260730
H 4.006703 0.035724 1.880363
H 0.176047 4.074534 1.306062
H -1.464118 4.925256 -0.378300
H 2.216714 -0.088665 -0.658226
H 3.238861 1.277642 -0.108359
H 5.297141 1.399180 -1.557170
H 6.293656 -0.073666 -1.656172
H 5.943184 0.653651 -0.064630
H 5.101229 -2.016856 -2.027979


%chk=000209363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209363

0 1
O 1.887805 0.708792 2.907371
O 3.308756 -2.213878 -1.520944
N 0.760115 -0.867247 1.611435
N 4.464932 -0.284443 -0.876248
C -1.651093 -0.234542 1.300117
C -1.692230 -1.272819 0.171931
C -0.525524 -0.606162 2.294378
C -1.619158 1.217938 0.760165
C -0.566563 -2.081938 -0.122966
C -2.890739 -1.430094 -0.581492
C 0.734491 -2.004898 0.669398
C -4.070727 -0.525767 -0.282289
C -2.619691 1.713459 -0.135914
C -3.812462 0.937570 -0.720654
C -0.634288 -3.027224 -1.177563
C -2.947997 -2.388613 -1.617331
C 1.909811 -0.202463 2.012322
C -0.594086 2.107581 1.185188
C -1.819498 -3.184830 -1.921564
C -2.538908 3.066124 -0.566728
C 3.216124 -0.555092 1.296128
C -0.534706 3.446640 0.746472
C -1.516000 3.935126 -0.142080
C 3.316170 0.185210 -0.070963
C 5.707465 0.501615 -0.891941
C 4.345466 -1.481390 -1.548730
H -2.592564 -0.335715 1.880296
H -0.353295 0.168521 3.056936
H -0.830746 -1.536656 2.816496
H 0.858814 -2.954413 1.238461
H 1.577386 -1.950008 -0.040933
H -4.965650 -0.889075 -0.821141
H -4.324995 -0.551287 0.795840
H -3.696580 0.937865 -1.824052
H -4.729957 1.525320 -0.513487
H 0.250537 -3.629942 -1.415640
H -3.875672 -2.507745 -2.190008
H 0.176619 1.766747 1.882844
H -1.864314 -3.918176 -2.734273
H -3.310104 3.439537 -1.253770
H 3.310631 -1.640243 1.121679
H 4.035995 -0.233881 1.959586
H 0.269848 4.098746 1.104674
H -1.489742 4.972916 -0.493105
H 2.397365 0.013335 -0.658727
H 3.418884 1.271611 0.094329
H 5.537551 1.503665 -1.328063
H 6.467036 -0.018899 -1.500560
H 6.111104 0.629459 0.129958
H 5.255983 -1.751234 -2.129344


