%chk=000217780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217780

0 1
N 4.082293 -1.021663 -1.043892
C -0.095103 -0.151790 0.417842
C 2.363615 -0.273915 0.597061
C 1.186979 -0.565671 -0.354873
C 0.264301 -0.426644 1.909665
C 1.797993 -0.441095 2.027590
C -0.359420 1.320766 0.106629
C -1.336949 -0.969260 0.078192
C 3.570285 -1.198639 0.351156
C -1.033614 1.657166 -1.081603
C -1.301250 -2.067804 -0.789112
C 0.093948 2.351662 0.940244
C -2.559904 -0.616190 0.678717
C -1.262252 2.992602 -1.415191
C -2.462762 -2.800847 -1.055425
C -0.136356 3.690362 0.604516
C -3.717246 -1.348494 0.413268
C 5.403086 -1.685402 -1.228207
C -0.815883 4.015765 -0.571116
C -3.672657 -2.444859 -0.456082
H 2.681439 0.786967 0.458343
H 1.295036 -0.026980 -1.310131
H 1.165252 -1.639923 -0.621599
H -0.147513 -1.405505 2.218448
H -0.195337 0.315118 2.581396
H 2.159317 0.364620 2.686769
H 2.135241 -1.385471 2.488287
H 3.265253 -2.264029 0.457163
H 4.343454 -1.013353 1.127879
H -1.385192 0.868492 -1.747514
H -0.361638 -2.362165 -1.261127
H 0.635059 2.121454 1.856419
H -2.603464 0.241587 1.349128
H 4.180533 -0.020774 -1.249285
H -1.789333 3.238559 -2.335358
H -2.419593 -3.651718 -1.733039
H 0.218368 4.480056 1.264074
H -4.657934 -1.065411 0.882186
H 6.205757 -1.321062 -0.570456
H 5.720991 -1.545985 -2.274718
H 5.294610 -2.770769 -1.067814
H -0.995999 5.055982 -0.830858
H -4.575510 -3.014440 -0.662973


%chk=000217780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217780

0 1
N 4.136257 -0.901370 -1.038780
C -0.120293 -0.265691 0.457478
C 2.338635 -0.243044 0.562198
C 1.157128 -0.789674 -0.277118
C 0.283724 -0.527337 1.949899
C 1.826024 -0.302669 2.039660
C -0.307879 1.238647 0.126279
C -1.417378 -1.022268 0.106759
C 3.660743 -1.002161 0.356488
C -0.743795 1.601271 -1.177763
C -1.476765 -2.031925 -0.886275
C -0.045124 2.281598 1.049368
C -2.612620 -0.703971 0.807817
C -0.906302 2.952121 -1.547528
C -2.687158 -2.711154 -1.163167
C -0.210466 3.639540 0.685404
C -3.820249 -1.380765 0.538929
C 5.404817 -1.602125 -1.306357
C -0.639531 3.982852 -0.614693
C -3.863541 -2.392452 -0.450198
H 2.500058 0.820115 0.285237
H 1.210720 -0.487440 -1.336212
H 1.178683 -1.897345 -0.243218
H 0.043853 -1.580946 2.181476
H -0.288158 0.089958 2.665408
H 2.081476 0.623941 2.584837
H 2.306306 -1.137441 2.585222
H 3.503992 -2.076361 0.589079
H 4.416891 -0.625824 1.095814
H -0.973962 0.811737 -1.903160
H -0.578393 -2.294132 -1.454284
H 0.288400 2.047029 2.065491
H -2.595197 0.090835 1.563520
H 4.161287 0.078330 -1.353247
H -1.247875 3.202379 -2.558626
H -2.708786 -3.487146 -1.937258
H -0.003247 4.426533 1.420055
H -4.727832 -1.118100 1.094778
H 6.254366 -1.285202 -0.650860
H 5.704872 -1.444919 -2.357737
H 5.264115 -2.689437 -1.159176
H -0.768989 5.033750 -0.897104
H -4.800908 -2.918437 -0.663837


