%chk=000299092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299092

0 1
O -0.780261 1.007470 0.182423
O -0.556236 -0.851877 1.465250
O 6.179816 -0.717867 -0.459818
O 5.774449 1.003798 -1.706487
N -4.090544 -1.039259 1.214510
N 5.438380 0.131516 -0.923666
C -3.044646 0.356714 -0.530894
C -4.320622 1.133071 -0.983011
C -2.500687 0.445836 -1.990456
C -3.772276 1.207883 -2.424206
C -3.305662 -1.086969 -0.063241
C -2.210833 1.134687 0.491057
C -3.504090 -1.949601 2.240820
C -5.527450 -1.366576 0.978602
C -0.070894 -0.024694 0.726626
C 1.354612 0.043900 0.279889
C 2.247582 -0.912313 0.787875
C 1.790427 1.028524 -0.617726
C 3.586868 -0.887143 0.396507
C 3.128618 1.060978 -1.014526
C 4.012345 0.100983 -0.502469
H -5.252016 0.561213 -0.867805
H -4.474564 2.099876 -0.494920
H -1.569155 1.016206 -2.084580
H -2.350426 -0.516998 -2.486889
H -3.590396 2.224049 -2.790395
H -4.381772 0.687655 -3.170845
H -3.818228 -1.657487 -0.864888
H -2.325130 -1.592464 0.090742
H -2.333851 2.229352 0.406481
H -2.394993 0.802107 1.530303
H -4.023548 -1.787902 3.197909
H -3.551832 -3.019723 1.996451
H -2.441390 -1.677193 2.394860
H -5.934073 -0.662273 0.229801
H -5.720785 -2.392491 0.633967
H -6.085266 -1.206980 1.915201
H 1.886784 -1.672892 1.489319
H 1.079140 1.767970 -1.001314
H 4.301357 -1.624115 0.780982
H 3.491148 1.822129 -1.714839


%chk=000299092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299092

0 1
O -0.978040 0.704433 0.013361
O -0.262963 1.690759 2.001907
O 6.250280 -0.502537 0.407932
O 5.459524 -1.419545 -1.524979
N -3.438708 -1.616816 0.762475
N 5.297532 -0.772107 -0.419921
C -3.296014 0.460663 -0.711347
C -4.698983 1.193410 -0.738234
C -3.043151 1.013493 -2.165337
C -4.230085 2.020529 -1.982860
C -3.261120 -1.081599 -0.605762
C -2.386296 1.105830 0.333399
C -2.906379 -2.987096 0.908626
C -4.820432 -1.504202 1.271610
C -0.015903 1.046605 0.952501
C 1.347248 0.560616 0.560780
C 2.426890 0.837926 1.438802
C 1.573298 -0.155919 -0.643224
C 3.727271 0.403900 1.124674
C 2.869493 -0.595489 -0.971057
C 3.926162 -0.308014 -0.079038
H -5.513591 0.490970 -0.987563
H -4.985920 1.761646 0.164230
H -2.041778 1.432012 -2.357996
H -3.261948 0.247420 -2.931758
H -3.888181 3.035164 -1.714652
H -4.943880 2.102659 -2.818039
H -4.018720 -1.498491 -1.320756
H -2.266452 -1.412070 -0.962357
H -2.435176 2.210156 0.314917
H -2.620381 0.735771 1.346685
H -2.976133 -3.300457 1.965933
H -3.450281 -3.745440 0.290146
H -1.841475 -3.006618 0.616861
H -5.140309 -0.449272 1.289919
H -5.561486 -2.078874 0.658633
H -4.863029 -1.887306 2.306742
H 2.222301 1.392971 2.359496
H 0.730758 -0.358028 -1.309002
H 4.578401 0.600783 1.781141
H 3.077557 -1.148737 -1.890288


