%chk=000225105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225105

0 1
O -1.063505 1.599312 -0.877248
O 4.390334 0.581618 -1.400481
O -4.137577 -0.442257 1.467526
O -2.504575 1.157118 -2.538405
O 0.241934 -3.440749 -0.708312
O -0.221192 -3.000124 1.435237
C 1.174342 -0.329713 0.073658
C 0.710614 1.032001 0.716000
C -1.288233 -0.405495 0.410749
C -0.798211 1.077128 0.493797
C -0.110547 -1.166273 -0.219633
C 1.993850 -0.032389 -1.203450
C -2.570170 -0.198252 -0.427238
C 3.248815 0.600804 -0.547814
C 2.229013 -1.000556 0.998510
C 1.438062 2.262306 0.145436
C 2.941902 2.036449 -0.065541
C 3.531700 -0.323853 0.640142
C -1.705169 1.860911 1.400530
C -3.619131 0.495828 0.515779
C -2.114986 0.879500 -1.441334
C -0.048052 -2.571276 0.320352
C -3.119611 -1.428633 -1.111590
C -3.013729 1.580780 1.391487
C 4.708000 -0.496950 1.228901
H 0.902291 0.988110 1.817250
H -1.539540 -0.826572 1.415296
H -0.239923 -1.225033 -1.334873
H 1.475635 0.632479 -1.909270
H 2.256072 -0.948275 -1.758937
H 2.317126 -2.087736 0.809761
H 1.980475 -0.901621 2.069116
H 1.279824 3.126961 0.817368
H 0.967098 2.550309 -0.821339
H 3.333140 2.769196 -0.795682
H 3.499055 2.237069 0.870279
H -1.259216 2.641296 2.010035
H -4.463020 0.898686 -0.091798
H -2.379952 -1.889623 -1.783315
H -3.410124 -2.199962 -0.385822
H -3.993660 -1.192375 -1.735926
H -3.735415 2.086239 2.034061
H 4.210275 1.052063 -2.237514
H 5.604673 0.007863 0.889654
H 4.871466 -1.157999 2.065595
H -4.618401 -1.166597 1.012374
H 0.306044 -4.388012 -0.410870


%chk=000225105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225105

0 1
O -1.157454 1.543668 -1.026290
O 4.660098 0.454644 -1.170621
O -4.092248 -0.492277 1.738272
O -2.915445 1.047980 -2.468573
O 0.558176 -3.279235 -1.165357
O -0.485412 -3.174465 0.904534
C 1.194419 -0.337664 -0.033278
C 0.726357 1.061151 0.559476
C -1.265015 -0.390193 0.372840
C -0.797665 1.082002 0.407770
C -0.140041 -1.103542 -0.412480
C 2.173468 -0.122360 -1.219727
C -2.641795 -0.228534 -0.314402
C 3.368461 0.539459 -0.476603
C 2.136382 -1.041779 0.993609
C 1.469416 2.266419 -0.066888
C 3.004707 2.032209 -0.159156
C 3.458741 -0.296895 0.813848
C -1.638961 1.899136 1.359773
C -3.616387 0.465552 0.723036
C -2.313722 0.825364 -1.404728
C -0.073442 -2.586009 -0.119583
C -3.274773 -1.491168 -0.913321
C -2.955090 1.594235 1.498374
C 4.548067 -0.360790 1.610266
H 0.926510 1.053339 1.650707
H -1.366903 -0.818618 1.384554
H -0.282539 -0.983766 -1.502665
H 1.750694 0.503565 -2.025322
H 2.479339 -1.095713 -1.645448
H 2.278943 -2.104748 0.712574
H 1.753510 -1.024847 2.029233
H 1.268959 3.182341 0.521069
H 1.053340 2.445299 -1.073091
H 3.404049 2.675822 -0.970022
H 3.516321 2.332080 0.772438
H -1.182544 2.732184 1.906169
H -4.485393 0.865234 0.154387
H -2.638100 -1.917886 -1.707426
H -3.407895 -2.264044 -0.136412
H -4.251490 -1.257544 -1.375856
H -3.605003 2.145576 2.187037
H 4.648317 1.081774 -1.938133
H 5.465444 0.175407 1.345515
H 4.563893 -0.971365 2.520703
H -4.777740 -1.081487 1.331866
H 0.615247 -4.245808 -0.930167


