%chk=000287049.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287049

0 1
O -5.911507 1.677579 0.399131
O -2.090601 0.305842 -1.185616
N 2.497477 -0.052543 -0.168285
N -3.307953 0.519003 0.774206
N 2.998039 2.254165 0.672339
N -2.711151 -1.658991 -0.129927
N 4.679117 0.940268 -0.522734
N 4.316630 -1.274782 -1.215830
N 5.261742 2.936548 0.633006
C 1.928662 1.293738 0.371576
C 1.715610 -1.255589 -0.028894
C 1.026824 1.877997 -0.725259
C 1.163125 1.011690 1.668893
C -4.514646 -0.019501 1.463858
C -3.476843 1.970421 0.454427
C 3.828725 -0.089317 -0.628276
C -5.789784 0.264602 0.650705
C -4.782016 2.228962 -0.312627
C -0.363881 -2.439517 -0.417929
C 0.424954 -1.295192 -0.576593
C -1.768039 -2.437626 -0.978326
C -2.674814 -0.244513 -0.259331
C 2.228064 -2.373614 0.657632
C 4.236424 2.050918 0.261142
C 0.142485 -3.555351 0.259653
C 1.437977 -3.515716 0.788029
H -4.576244 0.491879 2.454605
H -4.409895 -1.102350 1.672974
H -2.598746 2.325754 -0.134987
H -3.471726 2.520076 1.422135
H 1.561016 2.005015 -1.672881
H 0.140438 1.251760 -0.922561
H 0.668324 2.871608 -0.424524
H 0.907792 1.963204 2.159975
H 0.231045 0.464943 1.498197
H 1.770670 0.447475 2.386860
H -5.801137 -0.280033 -0.309695
H -6.710651 0.047226 1.221053
H -5.038838 3.302487 -0.357929
H -4.754602 1.803283 -1.331516
H 0.022268 -0.421185 -1.113899
H -1.769867 -2.001756 -2.010197
H -2.178783 -3.468379 -1.070856
H 3.230918 -2.343692 1.085540
H -2.823715 -2.043167 0.810683
H -0.462326 -4.451035 0.378332
H 1.832550 -4.384288 1.316103
H 5.226464 -1.193163 -1.664075
H 3.661355 -1.852122 -1.726220
H 6.108236 2.902729 0.080485
H 4.973137 3.865454 0.910527


%chk=000287049-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287049

0 1
O -6.096606 1.903048 0.863020
O -2.281401 0.043449 -1.675826
N 2.588514 -0.019423 -0.049541
N -3.760115 0.407066 0.099968
N 3.279349 2.086241 1.059045
N -2.597331 -1.661624 -0.109474
N 4.673750 1.024904 -0.659572
N 4.078356 -1.011953 -1.621406
N 5.501099 2.744533 0.683620
C 2.117609 1.322115 0.563999
C 1.830367 -1.237122 0.060362
C 1.387662 2.148955 -0.531011
C 1.197387 1.048455 1.768470
C -4.564537 -0.024501 1.259047
C -3.872417 1.844302 -0.234710
C 3.785510 0.029335 -0.762792
C -6.025807 0.455827 1.094073
C -5.349108 2.247884 -0.364381
C -0.241616 -2.519786 -0.297687
C 0.510991 -1.327300 -0.444671
C -1.676493 -2.570177 -0.821853
C -2.848946 -0.379783 -0.612720
C 2.411763 -2.369499 0.697758
C 4.410407 1.947611 0.379218
C 0.349829 -3.642810 0.328984
C 1.676709 -3.565950 0.818222
H -4.145472 0.394376 2.198398
H -4.575924 -1.125586 1.336346
H -3.328853 2.010360 -1.179463
H -3.396577 2.448258 0.565778
H 2.051559 2.300063 -1.400803
H 0.456611 1.659896 -0.870415
H 1.134760 3.140520 -0.116324
H 0.993180 2.018878 2.249550
H 0.241622 0.582883 1.475514
H 1.709109 0.404122 2.503475
H -6.497807 -0.085352 0.244855
H -6.601771 0.272663 2.016378
H -5.453907 3.339289 -0.474249
H -5.810142 1.737346 -1.236883
H 0.055604 -0.477383 -0.963191
H -1.705161 -2.260691 -1.881083
H -2.071957 -3.600500 -0.750660
H 3.428530 -2.292968 1.097367
H -2.802963 -1.878952 0.865551
H -0.221666 -4.573403 0.435241
H 2.130906 -4.434293 1.308569
H 4.977052 -0.973217 -2.095383
H 3.389930 -1.719157 -1.864376
H 6.380283 2.575391 0.205136
H 5.410430 3.454861 1.403630


