%chk=000206761.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206761

0 1
O 4.917267 -1.049682 0.572134
O 4.348411 1.179806 1.895545
N 3.940019 1.025761 0.554267
C -2.451371 -0.065746 -0.264268
C -0.900485 -0.053248 -0.241800
C -3.010102 -0.787738 0.981595
C -3.026691 1.365716 -0.321494
C -0.330435 -1.486756 -0.244756
C -0.321687 0.710562 -1.453748
C -4.544071 -0.818486 0.966614
C -4.561896 1.348092 -0.337430
C -5.126947 0.598326 0.876427
C 1.197804 -1.472430 -0.106261
C 1.842383 -0.461847 -1.014157
C 1.157125 0.525952 -1.607162
C 3.327825 -0.614377 -1.203315
C 4.096896 -0.314640 0.063643
H -2.790249 -0.617783 -1.173638
H -0.562429 0.460939 0.689910
H -2.655677 -0.280809 1.899064
H -2.617032 -1.821211 1.031809
H -2.658456 1.894342 -1.219639
H -2.668600 1.948400 0.548134
H -0.617132 -2.001060 -1.182042
H -0.773119 -2.081411 0.577548
H -0.554658 1.790818 -1.362003
H -0.819619 0.372053 -2.387790
H -4.918070 -1.323219 1.876759
H -4.899705 -1.425111 0.111873
H -4.921312 0.873089 -1.270403
H -4.947703 2.384393 -0.353197
H -6.229642 0.551479 0.813332
H -4.895512 1.157793 1.803004
H 1.597066 -2.486955 -0.310647
H 1.481464 -1.250989 0.944831
H 1.639903 1.251028 -2.260864
H 3.568516 -1.653722 -1.528047
H 3.705984 0.030019 -2.027809
H 3.013362 1.461211 0.523475
H 5.326174 0.893139 1.908505


%chk=000206761-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000206761

0 1
O 5.410479 -0.543130 0.295787
O 4.414424 1.344987 1.879150
N 3.653083 0.827026 0.775901
C -2.466489 -0.086682 -0.250850
C -0.905060 -0.101569 -0.235303
C -3.068683 -0.789287 0.998043
C -3.042305 1.353580 -0.357419
C -0.320950 -1.538092 -0.289616
C -0.299311 0.721157 -1.405944
C -4.615906 -0.771851 1.001805
C -4.589811 1.376930 -0.351458
C -5.166480 0.668047 0.894623
C 1.216402 -1.548044 -0.132609
C 1.898952 -0.508211 -1.011120
C 1.189058 0.497129 -1.596978
C 3.405639 -0.635223 -1.194209
C 4.229240 -0.141810 -0.000182
H -2.798042 -0.650125 -1.154047
H -0.573524 0.366103 0.719660
H -2.697112 -0.271272 1.908428
H -2.719355 -1.836705 1.062220
H -2.678747 1.845501 -1.279052
H -2.663122 1.954079 0.497715
H -0.592525 -1.990789 -1.265567
H -0.765064 -2.174889 0.496151
H -0.477116 1.802992 -1.247851
H -0.833067 0.468084 -2.349056
H -4.994863 -1.261911 1.919856
H -4.989478 -1.368955 0.143720
H -4.962775 0.865337 -1.263429
H -4.950150 2.422992 -0.402567
H -6.273033 0.656706 0.854555
H -4.882932 1.237311 1.804309
H 1.611773 -2.552485 -0.386804
H 1.493849 -1.383138 0.930550
H 1.712006 1.202545 -2.261428
H 3.703566 -1.688790 -1.348604
H 3.744583 -0.069222 -2.083227
H 2.734867 1.255854 0.669448
H 5.265577 0.801517 1.783398


