%chk=000273217.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273217

0 1
O -0.234441 0.294791 -1.022167
O -5.455807 0.741593 0.100822
O 3.948540 -1.854144 0.771598
O 1.557907 -4.808449 0.242888
N -0.290613 -2.371908 -0.675735
N 2.694189 -0.215614 -0.264831
N 0.671250 -2.264777 0.102465
C -2.190168 -0.821683 -0.252780
C -3.566654 -0.689540 0.042558
C -2.004412 1.717117 -0.403409
C -3.373806 1.850326 -0.117408
C -1.375050 0.375235 -0.599376
C -4.249579 0.647454 0.010775
C -1.626412 -2.109574 -0.204758
C -4.336361 -1.799689 0.380309
C -1.203353 2.858783 -0.514186
C -3.932113 3.121720 0.050855
C -2.402548 -3.236619 0.157445
C -3.749173 -3.075837 0.444818
C 2.002026 -2.564235 -0.489075
C -1.762550 4.130111 -0.336420
C -3.123948 4.261331 -0.055937
C 3.462985 0.940856 0.110014
C 2.984076 -1.528359 0.106203
C 3.233157 2.157095 -0.588038
C 2.389335 -4.033734 -0.154230
C 4.417430 0.884468 1.137359
C 3.971225 3.288110 -0.220108
C 2.238689 2.252262 -1.698279
C 5.142016 2.028295 1.479615
C 4.919820 3.230056 0.805773
C 3.806487 -4.392929 -0.432528
H -5.402968 -1.672142 0.595988
H -0.132302 2.742688 -0.743605
H -5.001860 3.214575 0.264491
H -1.930316 -4.222483 0.206556
H -4.358869 -3.938279 0.723460
H 2.032203 -2.483801 -1.614049
H -1.131559 5.016093 -0.418001
H -3.562890 5.250698 0.080434
H 1.806597 -0.017831 -0.757882
H 4.602045 -0.054833 1.669994
H 3.808709 4.228929 -0.744499
H 1.206029 2.057320 -1.341600
H 2.233108 3.241889 -2.172852
H 2.449467 1.525296 -2.496519
H 5.881892 1.975462 2.277339
H 5.483710 4.120858 1.074141
H 4.146200 -4.099464 -1.432480
H 4.483561 -3.880583 0.286896
H 3.977700 -5.473901 -0.317943


%chk=000273217-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273217

0 1
O -0.199707 0.716845 -0.587823
O -5.536421 0.724350 0.787377
O 4.170905 -2.138123 0.534050
O 1.527482 -4.978996 -0.446689
N -0.140469 -1.885505 -0.509278
N 2.808093 -0.347456 -0.152432
N 0.800653 -2.459798 0.164055
C -2.136183 -0.554255 0.077012
C -3.500511 -0.540977 0.497620
C -2.290874 1.915810 -0.529097
C -3.665962 1.928022 -0.150146
C -1.459010 0.686960 -0.365233
C -4.321778 0.708823 0.412156
C -1.416823 -1.786628 0.117486
C -4.104845 -1.717584 0.997111
C -1.697920 3.095597 -1.043416
C -4.425106 3.115065 -0.292923
C -2.028735 -2.961499 0.628454
C -3.363944 -2.917127 1.077164
C 2.038866 -2.616074 -0.656773
C -2.462223 4.270165 -1.190593
C -3.829428 4.280720 -0.814404
C 3.586318 0.762230 0.322456
C 3.129500 -1.689324 -0.023794
C 3.483189 2.004862 -0.375794
C 2.402485 -4.121141 -0.729157
C 4.423584 0.639013 1.460054
C 4.215038 3.109111 0.122940
C 2.646882 2.141321 -1.635852
C 5.148497 1.755394 1.925458
C 5.041711 2.998376 1.263163
C 3.781985 -4.484701 -1.227875
H -5.149581 -1.665785 1.317858
H -0.638971 3.071713 -1.318065
H -5.475920 3.095289 0.012679
H -1.443711 -3.886992 0.649158
H -3.828220 -3.821550 1.483318
H 1.853745 -2.274305 -1.701305
H -1.998819 5.177078 -1.592897
H -4.420613 5.195591 -0.926105
H 1.894613 -0.116226 -0.568544
H 4.509929 -0.325890 1.962374
H 4.143039 4.067726 -0.404627
H 1.571474 1.969131 -1.443059
H 2.759817 3.150542 -2.066612
H 2.960281 1.411025 -2.406719
H 5.791540 1.650600 2.805946
H 5.600842 3.868887 1.623026
H 4.045140 -3.909126 -2.135413
H 4.522566 -4.203681 -0.456272
H 3.830198 -5.564496 -1.435915


