%chk=000207560.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207560

0 1
O -2.854146 -1.587411 0.152816
N 1.113870 0.705401 -0.354117
N 3.914773 0.152705 0.065135
N -2.632630 0.501389 -0.742588
N 6.143496 0.986948 0.023299
N -8.175799 -1.200351 -0.938414
C 1.579460 -0.666153 0.036577
C 2.014424 1.733270 0.264365
C 3.005633 -0.888340 -0.503495
C 3.452445 1.538147 -0.255655
C -0.312368 0.922155 0.048805
C -1.199938 0.321000 -1.065043
C 5.299684 -0.106009 0.065508
C 5.806842 -1.426803 0.218802
C -3.358973 -0.509465 -0.111768
C 7.178415 -1.604688 0.354826
C 7.473885 0.773511 0.166009
C 8.037902 -0.499198 0.331022
C -4.794277 -0.154367 0.170424
C -5.796599 -0.866141 -0.485868
C -5.098941 0.853143 1.092852
C -7.147661 -0.554943 -0.214738
C -6.440554 1.150911 1.357509
C -7.466005 0.460225 0.715052
H 0.893972 -1.415463 -0.418019
H 1.560781 -0.833587 1.136282
H 2.009410 1.700547 1.375897
H 1.658716 2.741197 -0.040418
H 3.358219 -1.901395 -0.207000
H 3.000771 -0.846316 -1.616755
H 3.499044 1.731396 -1.350307
H 4.128345 2.276620 0.236616
H -0.572088 0.468923 1.030114
H -0.515027 2.009729 0.142406
H -0.975204 0.802394 -2.041877
H -0.983338 -0.768892 -1.182784
H -3.043427 1.407233 -0.937295
H 5.130866 -2.276067 0.248893
H 7.586476 -2.608243 0.480286
H 8.099732 1.673994 0.134770
H 9.109416 -0.622253 0.435417
H -5.537893 -1.652861 -1.192249
H -4.307267 1.387785 1.610555
H -6.686760 1.932327 2.077377
H -8.503682 0.707466 0.922959
H -7.947348 -2.095768 -1.346456
H -9.095050 -1.193303 -0.521128


%chk=000207560-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207560

0 1
O -2.725412 -1.284305 -0.364535
N 1.154384 0.950730 -0.403323
N 3.920073 0.154103 -0.270058
N -2.619739 0.982117 -0.853979
N 6.023967 0.700005 0.636146
N -7.727707 -2.177215 0.332118
C 1.526374 -0.483660 -0.339142
C 2.135928 1.761014 0.361620
C 2.930536 -0.709634 -0.936183
C 3.543840 1.583512 -0.231516
C -0.256709 1.195591 -0.028350
C -1.199681 0.921738 -1.228782
C 5.209988 -0.256090 0.067899
C 5.686109 -1.593773 -0.143727
C -3.296924 -0.146041 -0.414109
C 6.990070 -1.924435 0.262910
C 7.281391 0.349824 1.015772
C 7.821059 -0.944960 0.862967
C -4.744040 0.045273 -0.031929
C -5.554753 -1.109887 -0.015742
C -5.296005 1.307296 0.318955
C -6.932665 -1.031531 0.325886
C -6.663914 1.387394 0.662482
C -7.482622 0.241224 0.662260
H 0.792578 -1.082057 -0.907217
H 1.518351 -0.854099 0.717325
H 2.156235 1.475460 1.443573
H 1.848895 2.826658 0.292375
H 3.196029 -1.770292 -0.806642
H 2.898697 -0.487962 -2.025011
H 3.548005 1.994451 -1.264113
H 4.302948 2.112347 0.364388
H -0.584901 0.565551 0.832280
H -0.358401 2.253046 0.281970
H -0.996257 1.650606 -2.032471
H -1.007918 -0.091070 -1.622636
H -3.126254 1.860928 -0.959009
H 5.064983 -2.354327 -0.622771
H 7.360473 -2.943631 0.104320
H 7.877070 1.156081 1.461758
H 8.840283 -1.171371 1.187554
H -5.086143 -2.068677 -0.266380
H -4.675046 2.208324 0.377084
H -7.097110 2.353807 0.944354
H -8.542854 0.322649 0.931749
H -7.331318 -3.084179 0.104408
H -8.710291 -2.130137 0.584073


