%chk=000260688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260688

0 1
O 5.175698 -0.946565 -0.640017
O -5.908318 0.307297 0.243966
C 2.100024 0.781815 0.286866
C 0.658473 0.908287 -0.228619
C 2.751498 -0.555167 -0.190158
C -0.169129 -0.265186 0.374329
C -1.655148 -0.196393 -0.107812
C 4.240770 -0.337025 0.272713
C 1.967049 -1.705772 0.461961
C -2.231379 1.187129 0.334734
C 0.481363 -1.631559 0.064997
C 3.123766 1.859333 -0.112363
C 0.045202 2.265681 0.157416
C 4.495463 1.186253 0.100742
C -1.425733 2.352416 -0.263823
C -2.483624 -1.301301 0.608150
C 2.744817 -0.719788 -1.718136
C -3.720482 1.310938 -0.021849
C -1.756945 -0.400117 -1.626895
C 4.560153 -0.845138 1.676667
C -4.536527 0.194906 0.649878
C -3.960924 -1.178914 0.355828
C -4.715906 -2.198800 -0.052492
H 2.056372 0.765895 1.406225
H 0.654840 0.818818 -1.342374
H -0.170867 -0.139204 1.485270
H 2.055803 -1.662642 1.563430
H 2.384492 -2.682599 0.159887
H -2.139772 1.247667 1.449185
H 0.376713 -1.856909 -1.015396
H -0.070435 -2.431791 0.593989
H 3.019128 2.770132 0.496445
H 2.992782 2.167191 -1.163476
H 0.618523 3.083202 -0.318926
H 0.136512 2.430632 1.247743
H 5.164894 1.344460 -0.766232
H 5.021404 1.606494 0.971029
H -1.854207 3.317371 0.066098
H -1.506752 2.348253 -1.367719
H -2.303503 -1.261242 1.701881
H -2.119869 -2.298550 0.288882
H 3.039431 -1.731000 -2.013309
H 1.753697 -0.520545 -2.141403
H 3.454301 -0.032187 -2.197243
H -3.862256 1.278195 -1.118274
H -4.117485 2.293632 0.296834
H -1.268193 -1.330156 -1.939094
H -2.800883 -0.458160 -1.954151
H -1.282244 0.420519 -2.175918
H 5.618976 -0.672044 1.911810
H 3.964193 -0.333586 2.439505
H 4.385034 -1.920425 1.777720
H -4.616901 0.349634 1.753496
H 5.064992 -1.912355 -0.664368
H -5.786145 -2.123310 -0.189330
H -4.332014 -3.184416 -0.261738
H -6.005024 0.141297 -0.714760


%chk=000260688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260688

0 1
O 5.315469 -1.105060 -0.406762
O -6.003408 0.324695 0.544107
C 2.130474 0.768260 0.193637
C 0.676455 0.905731 -0.303218
C 2.814798 -0.571200 -0.227510
C -0.163531 -0.299052 0.241447
C -1.677702 -0.213079 -0.187982
C 4.277514 -0.345020 0.337449
C 1.991987 -1.736795 0.374577
C -2.235731 1.163832 0.328362
C 0.507167 -1.667626 -0.077540
C 3.166439 1.853986 -0.196884
C 0.056649 2.255715 0.136749
C 4.551978 1.166534 0.038898
C -1.439035 2.365491 -0.228350
C -2.499297 -1.339441 0.528766
C 2.906410 -0.730841 -1.771164
C -3.757542 1.313190 0.101582
C -1.850568 -0.374963 -1.722050
C 4.434366 -0.679948 1.836696
C -4.559423 0.173518 0.779294
C -4.006776 -1.190864 0.370758
C -4.805344 -2.189488 -0.085847
H 2.071168 0.757982 1.306586
H 0.675615 0.876944 -1.412816
H -0.156477 -0.195312 1.354325
H 2.022328 -1.685008 1.481537
H 2.417620 -2.720057 0.083389
H -2.074085 1.157962 1.432238
H 0.445132 -1.877913 -1.161932
H -0.047973 -2.479386 0.429556
H 3.053301 2.774423 0.402588
H 3.042014 2.142684 -1.258087
H 0.622229 3.092045 -0.317696
H 0.168474 2.356938 1.238213
H 5.202715 1.229944 -0.849958
H 5.101767 1.631280 0.876672
H -1.859290 3.306190 0.180647
H -1.558558 2.423829 -1.328973
H -2.243759 -1.308760 1.611502
H -2.197563 -2.334751 0.155412
H 3.357722 -1.705578 -2.027750
H 1.914548 -0.680345 -2.251845
H 3.546624 0.042245 -2.227882
H -3.987167 1.322736 -0.984081
H -4.109405 2.279485 0.510840
H -1.422413 -1.334858 -2.062400
H -2.917631 -0.385324 -2.004838
H -1.356678 0.431279 -2.291168
H 5.462943 -0.434881 2.155409
H 3.733199 -0.105570 2.468700
H 4.261791 -1.755512 2.034051
H -4.470774 0.282609 1.878697
H 5.222991 -2.066287 -0.179621
H -5.893662 -2.074818 -0.132124
H -4.388323 -3.156334 -0.390332
H -6.164075 0.249141 -0.432074


