%chk=000208785.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208785

0 1
O -1.318232 -0.417475 3.099628
N 0.456346 -2.466633 -0.754385
N 3.086486 -1.338764 -0.384610
N -1.554802 -1.160467 -0.873125
N -0.399470 -1.348431 1.224690
C 1.143292 -1.837471 -1.932302
C 1.412461 -3.185038 0.142924
C 2.678513 -1.752960 -1.754952
C 2.579867 -2.305422 0.638699
C -2.594428 -0.410039 -0.267178
C -3.713220 0.007342 -1.181179
C -4.564072 1.120781 -0.548543
C -4.886344 0.799558 0.915857
C -3.601717 0.683700 1.746494
C -2.546562 -0.132913 1.064357
C -0.472083 -1.610471 -0.063538
C 2.915575 0.069760 -0.114588
C -1.425724 -0.612446 1.908783
C 3.496714 0.986283 -1.018850
C 2.296212 0.556972 1.051871
C 3.456201 2.353757 -0.747855
C 2.264763 1.926932 1.309086
C 2.840461 2.832870 0.412510
H 0.745668 -0.821484 -2.140538
H 0.901318 -2.476528 -2.811171
H 1.786896 -4.057864 -0.436945
H 0.855494 -3.594779 1.017976
H 3.149145 -2.741778 -1.957713
H 3.104652 -1.050937 -2.505015
H 2.267173 -1.776641 1.574573
H 3.445766 -2.948804 0.913846
H -3.325529 0.351035 -2.161437
H -4.354570 -0.876609 -1.392661
H -4.020765 2.085023 -0.607980
H -5.496280 1.253469 -1.128445
H -5.460064 -0.145505 0.978833
H -5.540718 1.582585 1.342760
H -3.824741 0.242706 2.743210
H -3.186431 1.692468 1.961240
H -1.631900 -1.442810 -1.846557
H 3.999530 0.627899 -1.913832
H 1.826839 -0.136091 1.760640
H 3.913458 3.053127 -1.446472
H 1.781043 2.289692 2.216675
H 2.812681 3.899004 0.618121


%chk=000208785-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208785

0 1
O -2.076103 -1.238740 3.331651
N 0.577071 -2.204655 -0.427848
N 3.126895 -1.333592 -0.484817
N -1.415185 -0.922691 -0.678633
N -0.727837 -1.709483 1.473718
C 1.071203 -1.859853 -1.778091
C 1.480810 -3.020206 0.407224
C 2.638877 -1.875024 -1.766726
C 2.847507 -2.284264 0.618091
C -2.562716 -0.298376 -0.148972
C -3.448811 0.431457 -1.140401
C -4.452537 1.362724 -0.418597
C -5.105124 0.636974 0.780655
C -4.042233 0.239341 1.829251
C -2.817945 -0.392752 1.200277
C -0.532283 -1.607267 0.160920
C 3.039393 0.079693 -0.284076
C -1.873285 -1.134459 2.080510
C 3.630731 0.950279 -1.247007
C 2.402774 0.664391 0.849170
C 3.583289 2.349326 -1.083541
C 2.379131 2.066534 1.013571
C 2.962284 2.922603 0.051984
H 0.754303 -0.829815 -2.033308
H 0.686460 -2.554857 -2.556289
H 1.639818 -3.994909 -0.093572
H 0.972802 -3.189200 1.369025
H 3.018033 -2.906682 -1.886061
H 3.010643 -1.287546 -2.620579
H 2.859793 -1.749604 1.578790
H 3.657579 -3.040946 0.651425
H -2.823130 1.018207 -1.844195
H -4.003108 -0.311266 -1.752311
H -3.920938 2.263098 -0.053535
H -5.221099 1.704407 -1.136739
H -5.627531 -0.270418 0.416211
H -5.870992 1.285325 1.245990
H -4.452804 -0.465154 2.575804
H -3.727004 1.127014 2.415123
H -1.271266 -0.906606 -1.688875
H 4.164051 0.524369 -2.104648
H 1.894287 0.037923 1.589027
H 4.054690 2.993386 -1.835213
H 1.881646 2.488589 1.894347
H 2.936759 4.009328 0.184171


