%chk=000190637.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190637

0 1
O -0.967302 -2.589456 -1.289567
O -3.133146 0.032494 2.952419
O 2.491313 1.681348 1.716503
O -2.914401 -3.629139 -0.891652
O 5.023296 -1.080203 -0.247666
O 4.720756 -3.294880 0.011333
C -1.161951 0.714141 0.471900
C -0.215737 1.861398 -0.014812
C -1.507748 -0.313603 -0.636758
C -0.678813 2.499170 -1.369661
C -2.035178 0.393708 -1.899764
C -1.028995 1.422754 -2.416655
C -2.468179 1.275794 1.075215
C -2.535280 -1.313356 -0.122891
C 1.229228 1.313097 -0.248673
C -0.351718 -1.287406 -1.016094
C -0.094355 2.955191 1.061643
C -3.476014 0.227872 1.562650
C -1.834626 3.496356 -1.232492
C -3.416551 -1.099296 0.849606
C 1.860555 0.621771 0.966427
C -2.262061 -2.630194 -0.769669
C 2.931561 -0.352624 0.559895
C 4.248282 0.135394 -0.007118
C 2.942685 -1.691469 0.636582
C 4.252295 -2.201749 0.132427
H -0.634720 0.166334 1.298856
H 0.192960 3.081344 -1.770353
H -3.002429 0.884159 -1.675560
H -2.257667 -0.351138 -2.689835
H -0.104263 0.913202 -2.752053
H -1.435404 1.908464 -3.326268
H -2.965892 1.941055 0.332966
H -2.218052 1.918926 1.950406
H 1.885580 2.171525 -0.520484
H 1.248802 0.643004 -1.126765
H 0.170898 -1.036511 -1.951836
H 0.366132 -1.462722 -0.201849
H 0.337240 2.560745 1.991588
H 0.578195 3.758653 0.736831
H -1.052433 3.417816 1.315074
H -4.514821 0.638243 1.527513
H -1.549057 4.372484 -0.640087
H -2.155398 3.865033 -2.213801
H -2.714290 3.041189 -0.752153
H -4.103144 -1.873151 1.198380
H 1.089922 0.134587 1.617152
H -3.681831 -0.665445 3.359832
H 2.787771 1.355023 2.591721
H 4.158486 0.644163 -0.981186
H 4.835172 0.749948 0.698046
H 2.193428 -2.381342 0.991137


%chk=000190637-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190637

0 1
O -1.183696 -2.525109 -1.668018
O -2.624133 -0.356489 2.974228
O 2.721999 1.990796 1.563246
O -3.243374 -3.519779 -1.184979
O 4.881307 -1.332824 -0.266847
O 4.557746 -3.445950 0.705018
C -1.189871 0.698661 0.427528
C -0.235211 1.889162 -0.000178
C -1.548551 -0.298206 -0.726704
C -0.676452 2.570688 -1.365217
C -2.049877 0.475237 -1.989267
C -1.010100 1.515235 -2.458371
C -2.513178 1.173365 1.106453
C -2.601787 -1.301257 -0.262355
C 1.223253 1.341356 -0.232479
C -0.445553 -1.318350 -1.165361
C -0.150873 2.958741 1.121888
C -3.333550 0.028539 1.717332
C -1.817090 3.618954 -1.277725
C -3.425434 -1.173771 0.805703
C 1.981428 0.823722 1.016204
C -2.463304 -2.561865 -1.050497
C 2.969628 -0.270730 0.685082
C 4.161144 -0.041761 -0.228652
C 2.993584 -1.560516 1.122964
C 4.169603 -2.277130 0.557408
H -0.663021 0.114822 1.212693
H 0.215222 3.134293 -1.716190
H -3.009781 0.972222 -1.756295
H -2.261332 -0.245553 -2.802305
H -0.087384 0.998570 -2.787823
H -1.395458 2.035336 -3.356374
H -3.156955 1.711614 0.388986
H -2.286810 1.870798 1.928779
H 1.844218 2.160859 -0.645540
H 1.210438 0.546737 -0.997474
H 0.179814 -0.993744 -2.009625
H 0.189000 -1.641369 -0.319572
H 0.135396 2.508022 2.088456
H 0.622607 3.707795 0.875605
H -1.104516 3.489534 1.270398
H -4.347393 0.395891 1.982387
H -1.568852 4.451054 -0.597462
H -1.980538 4.056747 -2.280436
H -2.779520 3.191051 -0.949029
H -4.104337 -1.997143 1.069349
H 1.270997 0.438768 1.776441
H -3.101556 -1.113313 3.401922
H 3.100461 1.747494 2.447435
H 3.866053 0.220514 -1.261588
H 4.845457 0.735505 0.154196
H 2.293230 -2.054525 1.797061


