%chk=000193405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193405

0 1
O 7.852356 -0.436088 1.339042
O -9.234197 0.984714 0.714840
N 5.021195 -0.770997 0.051883
C 4.792089 0.625037 -0.428296
C 5.948036 1.580868 -0.041722
C 6.331214 -1.323662 -0.398921
C 7.544382 -0.403929 -0.061338
C 7.297416 1.040072 -0.522356
C 3.456657 1.154311 0.135684
C 2.256612 0.375033 -0.417839
C 0.932963 0.905276 0.147921
C 6.533744 -2.712439 0.209200
C -0.264200 0.120412 -0.405617
C -1.590396 0.647955 0.158177
C -2.786847 -0.139083 -0.393649
C -4.112726 0.390110 0.169196
C -5.309940 -0.397553 -0.380344
C -6.631023 0.137820 0.183384
C -7.833351 -0.647146 -0.352760
C -9.146362 -0.076246 0.140724
C -10.357385 -0.926355 -0.137511
H 4.725575 0.576004 -1.547164
H 5.969438 1.736791 1.052581
H 5.770274 2.581311 -0.478382
H 6.274923 -1.413577 -1.517212
H 8.480588 -0.816568 -0.502631
H 7.356571 1.090678 -1.626426
H 8.116093 1.684949 -0.144698
H 3.457367 1.107059 1.241121
H 3.353844 2.227193 -0.118114
H 4.940709 -0.822813 1.071392
H 2.247811 0.431027 -1.523140
H 2.371603 -0.702550 -0.179220
H 0.821694 1.979882 -0.092803
H 0.943425 0.842981 1.253125
H 5.617582 -3.312943 0.142840
H 6.823372 -2.651768 1.267353
H 7.328059 -3.260166 -0.308656
H -0.152451 -0.954348 -0.163598
H -0.274376 0.179842 -1.511033
H -1.702132 1.722216 -0.085047
H -1.579179 0.589381 1.263693
H 7.138216 -0.024677 1.861900
H -2.675169 -1.212972 -0.148859
H -2.796973 -0.081371 -1.499161
H -4.101233 0.335199 1.275103
H -4.224297 1.464247 -0.076260
H -5.198597 -1.470697 -0.132576
H -5.319401 -0.341882 -1.485995
H -6.751495 1.213111 -0.063822
H -6.623442 0.096629 1.290913
H -7.831376 -0.636416 -1.462499
H -7.750786 -1.715258 -0.070350
H -10.378273 -1.811969 0.510893
H -11.284136 -0.366243 0.060002
H -10.398566 -1.276990 -1.174469


%chk=000193405-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193405

0 1
O 7.710582 -0.584516 1.594544
O -9.402415 0.893194 0.791415
N 5.052215 -0.728264 0.009251
C 4.910178 0.686964 -0.431086
C 6.110402 1.570336 0.015268
C 6.341772 -1.366792 -0.365125
C 7.571354 -0.536230 0.120935
C 7.464185 0.923454 -0.378928
C 3.557837 1.255037 0.052750
C 2.328123 0.543195 -0.553164
C 0.988248 1.034344 0.038342
C 6.381499 -2.818131 0.137929
C -0.238090 0.293040 -0.540404
C -1.582508 0.769812 0.053961
C -2.800277 -0.018646 -0.478613
C -4.146267 0.460056 0.110408
C -5.357735 -0.361783 -0.384751
C -6.700110 0.129472 0.200324
C -7.897419 -0.715655 -0.272563
C -9.258934 -0.224409 0.227775
C -10.441285 -1.167512 0.017671
H 4.907215 0.668762 -1.543436
H 6.059047 1.725483 1.115715
H 6.032017 2.576974 -0.440206
H 6.382514 -1.369700 -1.475786
H 8.505885 -1.003810 -0.236796
H 7.561175 0.927576 -1.484016
H 8.308849 1.510258 0.026544
H 3.516882 1.183104 1.162590
H 3.521047 2.337115 -0.186998
H 4.838400 -0.845680 1.012210
H 2.324352 0.697755 -1.652461
H 2.435439 -0.547263 -0.394730
H 0.877936 2.124976 -0.140473
H 1.004490 0.901709 1.140983
H 5.490562 -3.366844 -0.213158
H 6.412219 -2.847258 1.242733
H 7.285178 -3.336647 -0.230002
H -0.123000 -0.795819 -0.356556
H -0.257707 0.420229 -1.643066
H -1.718912 1.849784 -0.164206
H -1.545556 0.679337 1.159980
H 6.934712 -0.109478 1.990708
H -2.663459 -1.096647 -0.249866
H -2.834351 0.061447 -1.585453
H -4.099489 0.409469 1.218351
H -4.299810 1.529345 -0.144465
H -5.204003 -1.429622 -0.120746
H -5.399477 -0.319171 -1.493798
H -6.872077 1.186821 -0.076395
H -6.656510 0.111329 1.307027
H -7.942948 -0.727622 -1.384129
H -7.777202 -1.779873 0.020385
H -10.422993 -1.953534 0.798385
H -11.391151 -0.616721 0.103710
H -10.385127 -1.679346 -0.960018


