%chk=000297445.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297445

0 1
O -0.402044 -4.030137 -0.273598
O -1.583158 1.222341 1.452209
O 2.842681 -0.725218 -1.077805
N -3.407415 0.468480 0.288527
N 2.239510 1.412794 -0.498066
C -0.145291 -2.281241 1.356237
C -1.658040 -2.090939 1.079346
C 0.642546 -0.967988 1.181546
C 0.070068 -2.833609 2.773980
C -2.338570 -1.018184 1.934494
C 0.607679 -0.413096 -0.248820
C 0.380914 -3.360489 0.367311
C -2.384568 0.324926 1.222963
C 1.996420 0.052820 -0.652228
C -3.637087 1.723935 -0.512309
C 3.553685 2.066580 -0.836723
C 1.857731 -3.537602 0.239979
C -4.855425 1.470656 -1.418523
C -3.916826 2.886029 0.451893
C -2.390235 2.014574 -1.362717
C 4.661020 1.449273 0.031486
C 3.407613 3.568977 -0.532556
C 3.849842 1.846684 -2.327620
H -1.802770 -1.880339 -0.000255
H -2.166056 -3.066616 1.237939
H 1.690567 -1.124901 1.509268
H 0.233790 -0.196674 1.872775
H -0.437800 -3.795886 2.912733
H 1.131200 -2.984491 3.001683
H -0.328030 -2.145421 3.530257
H -3.353575 -1.349465 2.226759
H -1.794600 -0.882377 2.895716
H -0.150773 0.395414 -0.317080
H 0.279241 -1.178541 -0.982712
H 2.106006 -4.467672 -0.290892
H 2.305505 -2.712728 -0.360999
H 2.383355 -3.541312 1.199471
H -4.029973 -0.312476 0.099143
H 1.523782 2.006477 -0.082561
H -4.687476 0.645333 -2.119062
H -5.760995 1.249688 -0.843309
H -5.074296 2.359169 -2.023429
H -3.060144 3.047206 1.126653
H -4.791232 2.696549 1.081606
H -4.088338 3.821642 -0.087628
H -1.516142 2.194740 -0.718276
H -2.144872 1.182768 -2.029975
H -2.529167 2.906701 -1.980666
H 4.748661 0.368254 -0.165750
H 4.461338 1.569714 1.099955
H 5.634378 1.899242 -0.182091
H 2.617780 4.036190 -1.130477
H 3.189734 3.758318 0.524123
H 4.338967 4.098773 -0.765255
H 4.796554 2.308570 -2.620248
H 3.062630 2.254957 -2.967922
H 3.925703 0.769728 -2.553003


%chk=000297445-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297445

0 1
O -0.972746 -4.332519 -0.075877
O -0.693142 1.311114 0.962652
O 3.164840 -0.483281 -1.481665
N -2.871915 0.844709 0.279873
N 1.864380 1.163601 -0.426525
C -0.089851 -2.554596 1.376361
C -1.538923 -1.994751 1.211933
C 1.008929 -1.528439 0.951764
C 0.153129 -2.954322 2.865671
C -1.841378 -0.642792 1.940199
C 0.984041 -1.120328 -0.544238
C 0.029738 -3.848854 0.519084
C -1.746474 0.590222 1.030038
C 2.106110 -0.118260 -0.870285
C -3.044331 1.942833 -0.730716
C 2.801416 2.318795 -0.575406
C 1.390168 -4.530722 0.409717
C -4.488560 1.810169 -1.271977
C -2.856559 3.320981 -0.044810
C -2.026303 1.761507 -1.886999
C 4.134683 2.017778 0.160687
C 2.101168 3.540006 0.067959
C 3.069272 2.588507 -2.079932
H -1.772004 -1.906042 0.134889
H -2.231782 -2.768785 1.588977
H 2.006159 -1.947468 1.189512
H 0.890591 -0.622303 1.575117
H -0.556472 -3.736553 3.192823
H 1.180010 -3.327778 3.024089
H 0.022248 -2.077476 3.525564
H -2.859148 -0.690404 2.373835
H -1.146230 -0.477102 2.780385
H 0.001420 -0.685219 -0.801845
H 1.145375 -1.998218 -1.193777
H 1.268399 -5.503952 -0.090553
H 2.084234 -3.909939 -0.188153
H 1.861211 -4.678807 1.397480
H -3.668037 0.214547 0.405366
H 0.987279 1.325239 0.094617
H -4.645598 0.830909 -1.762811
H -5.233382 1.928010 -0.462299
H -4.680294 2.595898 -2.022259
H -1.841924 3.407697 0.376111
H -3.589761 3.454399 0.771230
H -3.006119 4.129542 -0.783006
H -0.991492 1.820667 -1.511678
H -2.167841 0.785090 -2.385027
H -2.169316 2.557183 -2.640395
H 4.603879 1.114874 -0.263770
H 3.954761 1.852597 1.238947
H 4.831381 2.869005 0.048567
H 1.148346 3.767469 -0.446113
H 1.882002 3.356471 1.136176
H 2.752702 4.428295 -0.004514
H 3.750450 3.451840 -2.195486
H 2.124100 2.815570 -2.606810
H 3.531163 1.703485 -2.547198


