%chk=000215193.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215193

0 1
O 1.060072 -0.505069 -1.909556
O 6.760714 0.769769 0.266637
N -0.916655 -0.795890 0.043782
C -3.839294 -1.053069 0.181268
C -2.906365 -2.277871 0.113037
C -3.145130 0.148798 -0.486183
C -1.540036 -1.965342 0.745412
C -1.780043 0.423144 0.164113
C 0.501409 -0.578289 0.476245
C -5.189294 -1.368679 -0.498551
C 1.207254 0.215485 -0.669629
C 0.679892 0.117676 1.827689
C -6.203691 -0.285715 -0.254056
C 2.694864 0.330817 -0.442479
C -6.873322 -0.212583 0.978163
C -6.489916 0.658763 -1.251923
C 3.222599 1.457831 0.213392
C 3.555320 -0.675916 -0.896047
C -7.816486 0.792303 1.205787
C -7.434998 1.661584 -1.018998
C 4.589509 1.569086 0.435988
C 4.935442 -0.586883 -0.689272
C -8.100183 1.731539 0.208834
C 5.437045 0.536862 -0.021202
C 7.748615 -0.208895 -0.186200
C 9.067083 0.400453 0.289539
C 10.246393 -0.485994 -0.090018
H -4.032124 -0.806106 1.253903
H -3.361077 -3.143672 0.626495
H -2.761253 -2.581333 -0.942725
H -3.009890 -0.045397 -1.567856
H -3.782782 1.049624 -0.410675
H -0.866912 -2.841755 0.622116
H -1.655709 -1.795360 1.837532
H -1.922476 0.746309 1.217882
H -1.275488 1.259820 -0.366612
H 0.989545 -1.589915 0.524163
H -5.578357 -2.337014 -0.121769
H -5.036297 -1.525956 -1.585165
H 0.737047 1.214456 -0.817885
H 0.106485 -0.382984 2.615272
H 1.733837 0.104451 2.136892
H 0.364486 1.165673 1.806167
H 0.137437 -0.856916 -1.981974
H -6.657811 -0.940031 1.757555
H -5.976052 0.611796 -2.209706
H 2.557688 2.252878 0.550341
H 3.135072 -1.532196 -1.431328
H -8.333154 0.843636 2.162722
H -7.653659 2.390506 -1.797679
H 5.020306 2.428452 0.942623
H 5.585548 -1.374806 -1.050711
H -8.835650 2.512179 0.387803
H 7.527779 -1.177943 0.290351
H 7.686513 -0.291311 -1.283836
H 9.183327 1.415451 -0.143503
H 9.029131 0.555260 1.387474
H 10.325314 -0.618523 -1.175704
H 11.191824 -0.046139 0.251609
H 10.171251 -1.482347 0.361453


%chk=000215193-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215193

0 1
O 0.777493 0.114524 -1.590587
O 6.932036 0.688646 0.271826
N -0.876560 -0.499890 0.338369
C -3.768343 -1.093218 0.176539
C -2.688706 -2.202680 0.149511
C -3.157739 0.225705 -0.354183
C -1.410265 -1.769258 0.896154
C -1.878105 0.600727 0.418483
C 0.502207 -0.149863 0.821806
C -5.037254 -1.524401 -0.616429
C 1.192789 0.696354 -0.316708
C 0.570234 0.528472 2.205848
C -6.195796 -0.544313 -0.491972
C 2.709979 0.689777 -0.201185
C -6.968461 -0.492363 0.698637
C -6.516995 0.355957 -1.540121
C 3.393429 1.700283 0.523927
C 3.471760 -0.339992 -0.799342
C -8.026085 0.433062 0.840326
C -7.574655 1.284710 -1.404532
C 4.793259 1.671836 0.669356
C 4.877784 -0.382757 -0.669337
C -8.332780 1.327642 -0.212123
C 5.541469 0.625614 0.074852
C 7.763304 -0.352719 -0.357197
C 9.218810 -0.047375 0.005490
C 10.189336 -1.076860 -0.613720
H -4.068431 -0.929379 1.235298
H -3.081376 -3.131987 0.608050
H -2.429299 -2.435294 -0.903037
H -2.909550 0.108385 -1.428650
H -3.890618 1.049765 -0.271399
H -0.629799 -2.546183 0.797361
H -1.643245 -1.665248 1.985528
H -2.144956 0.824495 1.479260
H -1.430922 1.514619 -0.012486
H 1.050104 -1.112387 0.865251
H -5.350763 -2.521939 -0.246755
H -4.759433 -1.650635 -1.681764
H 0.830980 1.748193 -0.240428
H 0.053185 -0.076444 2.973374
H 1.622199 0.644700 2.518724
H 0.109061 1.532821 2.191207
H -0.091647 -0.350728 -1.337073
H -6.742987 -1.188705 1.516801
H -5.935086 0.326049 -2.469836
H 2.826301 2.526772 0.970844
H 2.948821 -1.089487 -1.402110
H -8.613941 0.454125 1.765310
H -7.807693 1.970394 -2.227227
H 5.327488 2.449801 1.223451
H 5.438146 -1.187739 -1.154543
H -9.154677 2.044520 -0.105346
H 7.463042 -1.352925 0.021551
H 7.616382 -0.334288 -1.458011
H 9.466266 0.971965 -0.344759
H 9.317372 -0.041082 1.107056
H 10.127306 -1.075661 -1.718267
H 11.233200 -0.846759 -0.336399
H 9.967121 -2.102650 -0.263668


