%chk=000199361.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199361

0 1
O -1.711916 0.153656 1.819192
N 4.874237 -0.157206 -0.006640
C -2.336997 -1.182150 -0.149585
C -2.025508 -2.540178 0.508748
C -3.814288 -0.803359 0.061695
C -2.964462 -3.636628 -0.011756
C -4.753228 -1.903113 -0.448104
C -1.409285 -0.057924 0.416841
C -4.436293 -3.257365 0.200566
C -1.677395 1.285985 -0.254743
C -0.000724 -0.414520 0.296102
C -1.332259 1.468241 -1.602061
C -2.271531 2.332868 0.461529
C 1.172056 -0.686170 0.213721
C 2.569687 -1.011131 0.110534
C -1.588818 2.690770 -2.227822
C -2.524234 3.554677 -0.168745
C 3.445541 0.262405 0.151668
C -2.185879 3.734899 -1.513316
C 5.481776 -0.513931 1.319795
C 5.685217 0.885958 -0.717951
C 6.711769 -1.398085 1.108358
C 5.321489 0.910997 -2.203241
H -2.138280 -1.264879 -1.245607
H -2.125769 -2.455442 1.608213
H -0.974366 -2.825574 0.312574
H -4.037768 0.150576 -0.454156
H -3.994165 -0.611048 1.138422
H -2.742720 -4.592565 0.498069
H -2.774839 -3.812156 -1.088261
H -4.670359 -1.986654 -1.548790
H -5.802892 -1.622181 -0.241337
H -5.093618 -4.041308 -0.218214
H -4.659904 -3.214283 1.283708
H -1.539893 -0.666596 2.326587
H -0.858448 0.661322 -2.158854
H -2.528673 2.186690 1.514036
H 2.869207 -1.710612 0.924774
H 2.777444 -1.567570 -0.835194
H -1.321759 2.830523 -3.273364
H -2.984777 4.366588 0.390913
H 3.250457 0.831335 1.085013
H 3.149921 0.931370 -0.686975
H -2.384651 4.685797 -2.002886
H 4.726781 -1.079013 1.911174
H 5.750949 0.379229 1.924167
H 6.760966 0.616942 -0.612410
H 5.566617 1.898788 -0.276139
H 6.476541 -2.242275 0.445585
H 7.536745 -0.848904 0.640477
H 7.072963 -1.804040 2.058332
H 5.372963 -0.098169 -2.634389
H 4.302099 1.277182 -2.371223
H 6.006572 1.553532 -2.765031


%chk=000199361-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199361

0 1
O -1.748999 0.140612 1.977816
N 4.934992 -0.112247 -0.031640
C -2.367699 -1.179939 -0.062187
C -2.129146 -2.548148 0.626071
C -3.865401 -0.794104 0.011315
C -3.018087 -3.654921 0.008787
C -4.762414 -1.900879 -0.593490
C -1.435984 -0.048843 0.532924
C -4.515190 -3.273121 0.075504
C -1.711404 1.304062 -0.152295
C -0.010384 -0.422515 0.380917
C -1.336404 1.492654 -1.505535
C -2.361555 2.352770 0.538172
C 1.177117 -0.739808 0.257633
C 2.608982 -1.047856 0.104009
C -1.614308 2.710841 -2.162770
C -2.636702 3.574074 -0.119234
C 3.498373 0.229981 0.098503
C -2.267930 3.758076 -1.471160
C 5.557878 -0.467102 1.273395
C 5.712968 0.905643 -0.789775
C 6.774303 -1.401204 1.126606
C 5.462184 0.842886 -2.308536
H -2.083440 -1.281178 -1.131822
H -2.379200 -2.461496 1.705207
H -1.061422 -2.830861 0.552624
H -4.040316 0.159642 -0.519307
H -4.135162 -0.624271 1.072832
H -2.840089 -4.615246 0.531020
H -2.726578 -3.808152 -1.051294
H -4.553447 -1.986046 -1.680714
H -5.827251 -1.612946 -0.495661
H -5.133074 -4.054473 -0.408567
H -4.831268 -3.223889 1.138262
H -1.329678 -0.608062 2.471904
H -0.811231 0.692525 -2.040856
H -2.635642 2.202612 1.585252
H 2.936088 -1.723243 0.919276
H 2.789724 -1.594861 -0.840738
H -1.316958 2.845510 -3.209102
H -3.138420 4.381657 0.426349
H 3.286020 0.826894 1.017612
H 3.195553 0.854796 -0.759708
H -2.481899 4.705469 -1.978943
H 4.792059 -0.981006 1.884422
H 5.849399 0.449688 1.846412
H 6.785441 0.714198 -0.604056
H 5.507201 1.939954 -0.414077
H 6.478157 -2.331406 0.611235
H 7.585932 -0.933163 0.540582
H 7.186399 -1.659486 2.120116
H 5.723618 -0.157482 -2.695061
H 4.404348 1.039838 -2.561196
H 6.076244 1.598873 -2.833033


