%chk=000208491.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208491

1 1
O -1.733164 0.611730 1.839014
O 0.976427 1.772769 0.670682
O -2.027837 2.458316 0.589772
N -2.801607 -0.462642 -1.056365
C -2.879860 -0.946252 0.393932
C -3.067489 0.127350 1.489078
C -3.758375 0.674874 -1.322479
C -3.172097 -1.630766 -1.952971
C -1.397051 -0.026338 -1.406968
C -3.589517 -0.485845 2.773269
C 2.665381 1.500928 -1.460635
C -1.313701 1.823932 1.328542
C 2.172645 0.294182 -0.687481
C 1.325437 0.440274 0.433176
C 0.117830 2.081030 1.775766
C 2.178144 1.447998 -2.914304
C 4.192823 1.593576 -1.388269
C 2.554404 -1.008140 -1.025337
C 0.865191 -0.642738 1.181778
C 1.279359 -1.937635 0.824213
C 2.109142 -2.112514 -0.291488
C 0.852227 -3.114081 1.635591
H -1.942077 -1.516258 0.633406
H -3.717018 -1.681265 0.483355
H -3.689750 0.992049 1.157592
H -3.754784 0.972402 -2.388213
H -3.473442 1.592535 -0.748788
H -4.797355 0.416910 -1.053911
H -2.492414 -2.491220 -1.803515
H -3.112325 -1.357339 -3.024411
H -4.205038 -1.980527 -1.770608
H -1.135424 0.951460 -0.951739
H -1.263163 0.099329 -2.497196
H -0.632409 -0.753303 -1.061603
H -3.599664 0.262142 3.586296
H -4.617300 -0.859854 2.679036
H -2.959023 -1.307943 3.142597
H 2.243357 2.429635 -0.987348
H 0.391555 1.524951 2.693894
H 0.296109 3.173275 1.917608
H 1.088425 1.411002 -2.975338
H 2.507682 2.339666 -3.464900
H 2.580205 0.582169 -3.452000
H 4.687561 0.759371 -1.897376
H 4.556159 2.516902 -1.856094
H 4.544589 1.596082 -0.349189
H 3.223471 -1.163602 -1.875911
H 0.232367 -0.499213 2.055518
H 2.441479 -3.111280 -0.572830
H 1.669168 -3.420610 2.315315
H -0.016368 -2.914401 2.273376
H 0.624914 -3.994674 1.019662


%chk=000208491-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208491

1 1
O -1.750052 0.452429 1.125112
O 0.646912 1.471213 0.563315
O -2.131951 1.873449 2.939520
N -3.186138 0.034820 -1.421924
C -3.392786 -0.792750 -0.123136
C -3.140316 -0.078065 1.213882
C -3.729592 1.452745 -1.274781
C -3.946691 -0.674864 -2.544728
C -1.697846 0.093847 -1.806631
C -3.279788 -1.073355 2.376731
C 2.331582 1.099081 -1.705695
C -1.369336 1.435761 2.057643
C 2.204278 0.045920 -0.600520
C 1.391132 0.247925 0.546913
C 0.062748 1.920285 1.811283
C 2.004501 0.518212 -3.106812
C 3.750280 1.733123 -1.696459
C 2.936078 -1.166866 -0.649501
C 1.313638 -0.704276 1.589526
C 2.067016 -1.902635 1.527046
C 2.874383 -2.124816 0.383660
C 2.025890 -2.907337 2.665143
H -2.727045 -1.667602 -0.214595
H -4.440847 -1.139844 -0.135659
H -3.826699 0.775553 1.371734
H -3.685747 1.946679 -2.257612
H -3.106334 2.005728 -0.559132
H -4.772944 1.411958 -0.925835
H -3.624990 -1.726736 -2.586062
H -3.716528 -0.179960 -3.500450
H -5.028089 -0.620372 -2.345683
H -1.123543 0.522793 -0.974473
H -1.603575 0.711505 -2.713702
H -1.349844 -0.930712 -2.011091
H -3.132718 -0.550601 3.334507
H -4.290383 -1.520481 2.391864
H -2.535075 -1.883523 2.291811
H 1.607953 1.905722 -1.489752
H 0.683135 1.656485 2.690200
H 0.022148 3.022547 1.754433
H 0.994312 0.065303 -3.135618
H 2.049960 1.312973 -3.873817
H 2.726032 -0.265843 -3.400434
H 4.526967 0.975271 -1.908020
H 3.827423 2.522474 -2.466602
H 3.978322 2.185458 -0.715233
H 3.582244 -1.357747 -1.514095
H 0.671070 -0.537758 2.461065
H 3.465191 -3.044779 0.309739
H 2.923209 -2.813815 3.306133
H 1.144145 -2.760671 3.313226
H 2.006109 -3.945449 2.288766


