%chk=000191868.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191868

0 1
O 0.902140 1.030754 -0.630102
O 0.856587 -3.713655 -1.329329
N 5.102154 0.527085 0.126757
C -0.377781 0.521172 -0.184838
C -0.276893 -0.128931 1.207165
C -0.731592 -0.481290 -1.307600
C -1.382028 1.707648 -0.164015
C 0.765680 -1.246388 1.294612
C 0.417225 -1.414093 -1.684463
C 0.306105 -2.559181 0.661776
C 0.548025 -2.650473 -0.829613
C -2.811076 1.290568 0.027744
C 1.570310 2.035860 0.171124
C 3.048196 1.872373 -0.178501
C -3.624268 1.011087 -1.082381
C -3.352827 1.193778 1.319693
C 3.704715 0.739571 0.626983
C -4.955458 0.628299 -0.899796
C -4.684938 0.810749 1.496381
C -5.488900 0.524631 0.388759
C 5.102897 -0.235289 -1.157722
C 5.919184 -0.192708 1.149862
H -0.035041 0.648148 1.959364
H -1.274927 -0.517119 1.495358
H -1.021980 0.090071 -2.213994
H -1.628965 -1.057604 -1.009703
H -1.264622 2.273058 -1.113555
H -1.088769 2.429266 0.623844
H 1.718865 -0.900970 0.818922
H 1.009306 -1.428814 2.360366
H 0.319226 -1.722751 -2.747300
H 1.381762 -0.848938 -1.639230
H 0.814465 -3.417056 1.153197
H -0.775244 -2.729707 0.849661
H 1.360741 1.887154 1.242615
H 1.179701 3.016814 -0.152782
H 3.138810 1.664842 -1.267750
H 3.594713 2.820845 -0.012234
H -3.220978 1.095853 -2.089576
H -2.738455 1.422311 2.187704
H 3.064129 -0.178466 0.565584
H 3.747567 1.025571 1.699447
H -5.580062 0.411692 -1.765456
H -5.098509 0.737308 2.501146
H -6.525530 0.226074 0.528361
H 4.489388 0.303153 -1.899161
H 6.131783 -0.267764 -1.550069
H 4.726501 -1.266243 -1.086079
H 5.544543 -1.188053 1.428636
H 5.983176 0.426399 2.058631
H 6.947050 -0.307743 0.768755


%chk=000191868-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191868

0 1
O 1.000150 0.742290 -0.366581
O 0.452031 -4.196798 -0.868666
N 5.360627 0.780804 0.005596
C -0.399568 0.328629 -0.050040
C -0.497791 -0.260853 1.380011
C -0.711300 -0.707442 -1.161334
C -1.331581 1.585177 -0.200261
C 0.415714 -1.471859 1.679416
C 0.345859 -1.823959 -1.359995
C -0.049564 -2.811540 1.056679
C 0.261121 -3.028080 -0.428695
C -2.828313 1.324188 -0.096175
C 1.633709 1.778408 0.464317
C 3.094505 1.889025 0.008386
C -3.601980 1.025911 -1.249240
C -3.495141 1.394322 1.156164
C 3.924092 0.633443 0.347117
C -4.990775 0.785071 -1.153187
C -4.883709 1.154198 1.258432
C -5.637581 0.844300 0.102977
C 5.605919 0.827811 -1.451583
C 6.186123 -0.259846 0.654815
H -0.277953 0.545333 2.109187
H -1.552168 -0.548128 1.558567
H -0.771920 -0.148394 -2.114401
H -1.712785 -1.140220 -0.982501
H -1.090710 2.038042 -1.181092
H -1.043066 2.316579 0.579278
H 1.452844 -1.246020 1.363898
H 0.444815 -1.609276 2.777789
H 0.296157 -2.219753 -2.389968
H 1.346558 -1.360561 -1.240662
H 0.386758 -3.673182 1.594596
H -1.151102 -2.904693 1.177409
H 1.583050 1.506794 1.540996
H 1.120468 2.752804 0.325971
H 3.097202 2.081234 -1.080549
H 3.562972 2.762868 0.501173
H -3.113004 0.990996 -2.230399
H -2.923409 1.651522 2.056779
H 3.466229 -0.257371 -0.155536
H 3.860576 0.457768 1.439951
H -5.568165 0.558752 -2.056734
H -5.377682 1.216845 2.234769
H -6.715211 0.661437 0.178790
H 5.079296 1.684342 -1.904590
H 6.686526 0.961696 -1.637278
H 5.274211 -0.102779 -1.980427
H 5.941991 -1.299226 0.315167
H 6.047269 -0.216964 1.750035
H 7.253810 -0.074749 0.438831


