%chk=000286158.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286158

0 1
O 1.600655 0.343799 0.055619
O -6.147084 0.044152 2.105004
O -4.974886 1.718595 1.392998
O 1.838405 -1.883761 -0.260159
N 5.909778 0.334067 -0.203860
N -4.580126 -1.080831 -0.197802
N -5.558794 0.662544 1.238347
C 5.090319 0.893192 -1.329616
C 3.650252 0.360121 -1.275669
C -5.545185 0.015033 -0.229428
C 7.189468 1.102363 -0.040022
C 6.174834 -1.131745 -0.397473
C 3.054490 0.514169 0.119504
C -6.950098 -0.544107 -0.455819
C -5.202518 1.114325 -1.224527
C 6.909817 2.458790 0.609631
C 6.609318 -1.764886 0.925091
C -3.172056 -0.970398 -0.160568
C -0.370728 -0.914829 -0.129427
C -2.437050 -2.173221 -0.319875
C -2.494653 0.250156 0.030392
C -1.049445 -2.135716 -0.305027
C -1.102937 0.270231 0.044548
C 1.104310 -0.927598 -0.124939
H 5.524213 0.679724 -2.330471
H 5.072635 2.001743 -1.222452
H 3.616047 -0.711868 -1.568928
H 3.026621 0.895848 -2.017197
H 7.862738 0.515183 0.625676
H 7.735083 1.240745 -0.998052
H 5.227266 -1.615887 -0.732422
H 6.930240 -1.332175 -1.186711
H 3.129402 1.539997 0.519389
H 3.468666 -0.215307 0.838084
H -4.971719 -2.016257 -0.070279
H -7.265421 -1.233133 0.345437
H -7.706834 0.253113 -0.484709
H -7.018280 -1.080450 -1.412168
H -4.325619 1.711991 -0.912339
H -6.027683 1.826811 -1.353491
H -4.967626 0.692312 -2.211937
H 6.348456 3.125763 -0.053808
H 6.311541 2.336616 1.523038
H 7.842041 2.962687 0.883448
H 7.592995 -1.409200 1.250450
H 5.897905 -1.520327 1.726113
H 6.653559 -2.855569 0.840393
H -2.949146 -3.122220 -0.457464
H -3.045190 1.181151 0.191108
H -0.468471 -3.055891 -0.430326
H -0.568503 1.214256 0.197394


%chk=000286158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286158

0 1
O 1.601708 0.789744 0.081283
O -5.558906 0.311618 2.105730
O -5.632577 2.118183 0.721140
O 1.956335 -1.521026 0.087888
N 5.943355 0.309167 -0.239903
N -4.543817 -1.155792 -0.128111
N -5.591212 0.855258 0.945772
C 5.224216 1.164513 -1.222216
C 3.698171 0.915389 -1.260923
C -5.582637 -0.191162 -0.342805
C 7.311286 0.825178 0.041432
C 5.943584 -1.131370 -0.625273
C 3.079962 0.995522 0.141364
C -6.955874 -0.883437 -0.240625
C -5.450443 0.639026 -1.627658
C 7.318852 2.068015 0.953021
C 6.213092 -2.076092 0.561443
C -3.149998 -0.933956 -0.087159
C -0.315253 -0.640965 0.012851
C -2.299365 -2.077936 -0.049265
C -2.558876 0.361897 -0.058587
C -0.906680 -1.932671 0.002672
C -1.159559 0.497801 -0.013830
C 1.165884 -0.539701 0.062029
H 5.634931 1.040466 -2.258330
H 5.400240 2.218870 -0.938445
H 3.469905 -0.074077 -1.695465
H 3.234669 1.673904 -1.920540
H 7.875591 0.021563 0.546878
H 7.862498 1.049479 -0.908790
H 4.944412 -1.375170 -1.025800
H 6.679098 -1.328208 -1.447486
H 3.190931 1.999563 0.583429
H 3.529287 0.240206 0.805409
H -4.851046 -2.057718 0.240028
H -7.063538 -1.394950 0.731924
H -7.768387 -0.145326 -0.337143
H -7.057842 -1.619183 -1.057349
H -4.454672 1.088389 -1.746699
H -6.197133 1.447545 -1.643890
H -5.628520 -0.034851 -2.483721
H 6.820590 2.935642 0.483889
H 6.796824 1.844640 1.899784
H 8.358033 2.368568 1.183833
H 7.213739 -1.925436 1.005895
H 5.456997 -1.915927 1.349390
H 6.150999 -3.128870 0.228958
H -2.743604 -3.080819 -0.069037
H -3.175867 1.263897 -0.030210
H -0.250210 -2.808482 0.030224
H -0.708169 1.493185 0.017692


