%chk=000299877.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299877

0 1
O -1.461577 0.310747 1.195070
O 2.489022 0.139439 1.374653
O -2.727337 -1.491342 0.661886
O 1.780069 -2.044683 1.510237
N 0.753665 -0.501742 0.085088
N -1.008702 1.176683 -1.940585
N -2.478857 -0.116372 -3.093812
N -1.905020 1.913405 -2.649475
N -2.779783 1.118167 -3.339372
C -0.425069 -1.344584 -0.180049
C -0.735095 -1.359423 -1.692122
C -1.682285 -0.894178 0.584705
C -1.362313 -0.118289 -2.203525
C -2.598580 0.966888 1.847150
C 1.671606 -0.924347 1.051680
C -3.323445 1.792332 0.822463
C 3.668755 -0.172364 2.188020
C 4.779542 -0.666493 1.307221
C -3.053653 3.162360 0.697608
C -4.266497 1.185589 -0.020930
C 4.826991 -2.019348 0.938039
C 5.769671 0.216733 0.854723
C -3.733491 3.922709 -0.258733
C -4.941225 1.949182 -0.976233
C -4.677888 3.318345 -1.094315
C 5.866087 -2.485627 0.129644
C 6.808764 -0.255371 0.047231
C 6.859043 -1.605408 -0.314101
H -0.199553 -2.406122 0.156576
H 0.211315 -1.555152 -2.255921
H -1.404306 -2.228639 -1.916366
H 0.655791 0.502841 -0.111503
H -2.086046 1.563985 2.624249
H -3.242953 0.198963 2.317108
H 3.866232 0.817059 2.642774
H 3.383671 -0.903977 2.968823
H -2.315507 3.636381 1.342984
H -4.464655 0.112676 0.066786
H 4.040569 -2.701403 1.276313
H 5.729960 1.270432 1.125616
H -3.533984 4.989531 -0.343957
H -5.669733 1.474353 -1.634363
H -1.934587 2.930895 -2.608849
H -5.213708 3.912195 -1.833342
H 5.901405 -3.535926 -0.155661
H 7.578212 0.430684 -0.302387
H 7.669379 -1.971082 -0.942444


%chk=000299877-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299877

0 1
O -1.829658 0.149153 1.508621
O 2.442866 0.143059 1.399147
O -3.042217 -1.495569 0.383750
O 1.762140 -2.112811 1.597994
N 0.508345 -0.520767 0.413659
N -1.121142 0.817703 -1.639555
N -1.637772 -0.439395 -3.487927
N -1.619707 1.569261 -2.665015
N -1.946558 0.846484 -3.801216
C -0.595763 -1.418807 0.103417
C -0.753118 -1.675977 -1.423867
C -1.952788 -0.946526 0.669443
C -1.147611 -0.440710 -2.180585
C -3.123337 0.808565 1.933267
C 1.577063 -0.939581 1.170420
C -3.563391 1.802401 0.880449
C 3.708740 -0.194024 2.136946
C 4.821270 -0.591428 1.190619
C -2.989864 3.098910 0.836713
C -4.529447 1.439885 -0.093039
C 4.963973 -1.941965 0.777296
C 5.735114 0.379212 0.707486
C -3.369959 4.018395 -0.166714
C -4.913710 2.358234 -1.096044
C -4.334517 3.649195 -1.136458
C 6.001070 -2.310430 -0.107759
C 6.773384 0.011542 -0.177424
C 6.908190 -1.335643 -0.586706
H -0.358684 -2.388087 0.583232
H 0.200560 -2.076051 -1.812571
H -1.529508 -2.443672 -1.584780
H 0.420445 0.466245 0.162820
H -2.843765 1.292316 2.881553
H -3.874673 0.018756 2.101682
H 3.937952 0.742436 2.669489
H 3.474944 -1.000405 2.853109
H -2.241893 3.384472 1.586173
H -4.961787 0.433480 -0.069561
H 4.250196 -2.688235 1.143909
H 5.630731 1.424482 1.024241
H -2.931392 5.022645 -0.183020
H -5.661597 2.069371 -1.842291
H -1.809642 2.567836 -2.570902
H -4.643998 4.366466 -1.905391
H 6.104475 -3.355207 -0.421581
H 7.475602 0.769027 -0.543340
H 7.714338 -1.623539 -1.271086


