Gaussian 16 14-Dec-2025 Gaussian 16 7-Dec-2021 ES64L-G16RevC.02 18 18 58 58 564 (5D, 7F) CBSB3** 17 C2V[SGV(C10H2F6)] RMN15 6-311G(2df,2p) SP #P MN15/6-311G(2df,2p) sp IOP(3/5=12) 234.09741919999993 0 1 AuxInfo=1/0/N:1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16;17;18/rA:18nC0C0C0C0C0C0C0C0C0C0F0F0F0F0F0F0H0H0/rB:;;;;;;;;;;;;;;;;;/rC:-.1758,-.7048,0;-.1758,.7048,0;1.053,1.3795,0;-1.398,-1.3995,0;1.053,-1.3795,0;-1.398,1.3995,0;2.2263,.7011,0;-2.5552,-.702,0;2.2263,-.7011,0;-2.5552,.702,0;1.0653,2.6965,0;1.0653,-2.6965,0;-3.7173,-1.3163,0;3.3762,1.3287,0;-3.7173,1.3163,0;3.3762,-1.3287,0;-1.42,-2.4764,0;-1.42,2.4764,0; /prod/precompiled/gaussian/16c2/g16/g16 /prod/precompiled/gaussian/16c2/g16/l1.exe "/data/udgqfd/ocharapale/fluronapthalene/sp/6F_isomer_71_tmp/Gau-3512.inp" -scrdir="/data/udgqfd/ocharapale/fluronapthalene/sp/6F_isomer_71_tmp/" nproc=32 mem = 60GB chk=6F_isomer_71.chk #P MN15/6-311G(2df,2p) sp IOP(3/5=12) 1/38=1,172=1/1 2/12=2,17=6,18=5,40=1/2 3/5=12,6=6,7=204,11=2,25=1,30=1,74=-73/1,2,3 4//1 5/5=2,38=5/2 6/7=2,8=2,9=2,10=2,28=1/1 99/5=1,9=1/99 6F_isomer_71 opt 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 12 12 12 12 12 12 12 12 12 12 19 19 19 19 19 19 1 1 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 12.0000000 18.9984032 18.9984032 18.9984032 18.9984032 18.9984032 18.9984032 1.0078250 1.0078250 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 1 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 (Enter /prod/precompiled/gaussian/16c2/g16/l101.exe) 0.10000e-02 0.10000e-05 F 224 98 98 224 A1 A2 B1 B2 192 90 90 192 A1 A2 B1 B2 856 644 1107.1076612232 9 4.00e+00 60 F IExCor= 7252 DFT=T Ex+Corr=MN15 ExCW=0 ScaHFX= 0.440000 ScaDFX= 1.000000 1.000000 1.000000 1.000000 ScalE2= 1.000000 1.000000 IRadAn= 5 IRanWt= -1 IRanGd= 0 ICorTp=0 IEmpDi= 4 NPDir=0 NMtPBC= 1 NCelOv= 1 NCel= 1 NClECP= 1 NCelD= 1 NCelK= 1 NCelE2= 1 NClLst= 1 CellRange= 0.0. One-electron integrals computed using PRISM. One-electron integral symmetry used in STVInt NBasis= 564 RedAO= T EigKep= 1.11D-06 NBF= 192 90 90 192 NBsUse= 562 1.00D-06 EigRej= 5.42D-07 NBFU= 192 90 90 190 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 234.09741919999993 AuxInfo=1/0/N:1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16;17;18/rA:18nC0C0C0C0C0C0C0C0C0C0F0F0F0F0F0F0H0H0/rB:;;;;;;;;;;;;;;;;;/rC:-.1758,-.7048,0;-.1758,.7048,0;1.0529,1.3795,0;-1.3979,-1.3995,0;1.0529,-1.3795,0;-1.3979,1.3995,0;2.2263,.7011,0;-2.5552,-.702,0;2.2263,-.7011,0;-2.5552,.702,0;1.0653,2.6965,0;1.0653,-2.6965,0;-3.7173,-1.3163,0;3.3762,1.3287,0;-3.7173,1.3163,0;3.3762,-1.3287,0;-1.42,-2.4764,0;-1.42,2.4764,0; 0.000000 1.409536 0.000000 2.419523 1.401813 0.000000 1.405815 2.433422 3.705374 0.000000 1.401813 2.419523 2.759072 2.450975 0.000000 2.433422 1.405815 2.450975 2.798954 3.705374 0.000000 2.783228 2.402087 1.355397 4.188968 2.388649 3.690934 0.000000 2.379439 2.764195 4.165540 1.351191 3.671221 2.399076 4.983129 0.000000 2.402087 2.783228 2.388649 3.690934 1.355397 4.188968 1.402118 4.781521 0.000000 2.764195 2.379439 3.671221 2.399076 4.165540 1.351191 4.781521 1.404042 4.983129 0.000000 3.620611 2.346752 1.317006 4.779597 4.076039 2.783861 2.308597 4.965690 3.590432 4.133536 0.000000 2.346752 3.620611 4.076039 2.783861 1.317006 4.779597 3.590432 4.133536 2.308597 4.965690 5.392968 0.000000 3.593943 4.077644 5.479316 2.320855 4.770677 3.571402 6.276649 1.314461 5.975374 2.328969 6.243073 4.977791 0.000000 4.092904 3.606402 2.323848 5.498714 3.568232 4.774710 1.310074 6.269452 2.332875 5.964469 2.685365 4.641396 7.570637 0.000000 4.077644 3.593943 4.770677 3.571402 5.479316 2.320855 5.975374 2.328969 6.276649 1.314461 4.977791 6.243073 2.632606 7.093561 0.000000 3.606402 4.092904 3.568232 4.774710 2.323848 5.498714 2.332875 5.964469 1.310074 6.269452 4.641396 2.685365 7.093561 2.657418 7.570637 0.000000 2.164883 3.415825 4.580788 1.077146 2.705272 3.875938 4.836492 2.106458 4.055521 3.375070 5.738938 2.495024 2.573622 6.122303 4.434218 4.931627 0.000000 3.415825 2.164883 2.705272 3.875938 4.580788 1.077146 4.055521 3.375070 4.836492 2.106458 2.495024 5.738938 4.434218 4.931627 2.573622 6.122303 4.952796 0.000000 C10H2F6 C2V 4 C2V 4 C2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 234.09741919999993 AuxInfo=1/0/N:1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16;17;18/rA:18nC0C0C0C0C0C0C0C0C0C0F0F0F0F0F0F0H0H0/rB:;;;;;;;;;;;;;;;;;/rC:0,.7048,.1758;0,-.7048,.1758;0,-1.3795,-1.0529;0,1.3995,1.3979;0,1.3795,-1.0529;0,-1.3995,1.3979;0,-.7011,-2.2263;0,.702,2.5552;0,.7011,-2.2263;0,-.702,2.5552;0,-2.6965,-1.0653;0,2.6965,-1.0653;0,1.3163,3.7173;0,-1.3287,-3.3762;0,-1.3163,3.7173;0,1.3287,-3.3762;0,2.4764,1.42;0,-2.4764,1.42; 0.9192414 0.3729195 0.2652944 Precomputing XC quadrature grid using IXCGrd= 4 IRadAn= 5 IRanWt= -1 IRanGd= 0 AccXCQ= 0.00D+00. Generated NRdTot= 0 NPtTot= 0 NUsed= 0 NTot= 32 NSgBfM= 643 643 643 643 643 MxSgAt= 18 MxSgA2= 18. 1 = 3.60D-02 ExpMax= 1.14D+04 ExpMxC= 1.72D+03 IAcc=3 IRadAn= 5 AccDes= 0.00D+00 functional with IExCor= 1009 and IRadAn= 5 diagonalized for initial guess. : IExCor= 1009 AccDes= 0.00D+00 IRadAn= 5 IDoV= 1 UseB2=F ITyADJ=14 (B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A1)|(A1)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(B2)|(B1)|(B2)|(B1)|(A2)|(A1)|(B1)|(A2)|(A2)|(B2)|(A1)|(B2)|(B1)|(B2)|(A1)|(A1)|(A2)|(B1)|(B1)|(A2) (B1)|(A2)|(B1)|(A1)|(A1)|(B2)|(A1)|(A2)|(B2)|(A1)|(B1)|(A1)|(B2)|(A2)|(A1)|(B1)|(B2)|(A1)|(A1)|(A2)|(A1)|(B2)|(B2)|(B1)|(A2)|(B2)|(A1)|(B1)|(A1)|(B2)|(B2)|(A2)|(A1)|(B1)|(B2)|(A1)|(B2)|(A1)|(A1)|(B2)|(A2)|(A2)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(B2)|(A1)|(B2)|(B1)|(A1)|(B2)|(A1)|(A1)|(B2)|(B2)|(B1)|(A1)|(A1)|(B2)|(A1)|(A2)|(B2)|(A1)|(B2)|(A1)|(B1)|(A1)|(B2)|(A2)|(A1)|(A1)|(B2)|(B2)|(B1)|(A2)|(A1)|(B2)|(B1)|(A1)|(B2)|(B2)|(B2)|(B1)|(A1)|(B1)|(B2)|(B1)|(B2)|(A1)|(A1)|(A2)|(B2)|(B1)|(B2)|(A2)|(A1)|(A1)|(B1)|(A2)|(B2)|(A2)|(A1)|(B2)|(B1)|(B2)|(A1)|(B1)|(A1)|(A1)|(A2)|(B2)|(A1)|(B2)|(A2)|(A1)|(B1)|(B2)|(A2)|(A1)|(B2)|(A1)|(B1)|(A1)|(A2)|(B2)|(A1)|(B2)|(B2)|(B1)|(A1)|(B2)|(A1)|(A2)|(A1)|(B2)|(A2)|(A1)|(B2)|(A1)|(B1)|(B1)|(A1)|(A1)|(B2)|(A2)|(B2)|(A2)|(B1)|(B2)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(B1)|(A2)|(A1)|(A2)|(B1)|(B2)|(B2)|(B2)|(A1)|(B1)|(A2)|(B2)|(B1)|(A1)|(A2)|(A1)|(A2)|(B2)|(A1)|(A1)|(A1)|(B2)|(A1)|(B2)|(A2)|(A1)|(B2)|(A2)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(B2)|(B2)|(B2)|(A1)|(B2)|(B2)|(B2)|(A1)|(B1)|(A1)|(B1)|(A1)|(B2)|(A2)|(B1)|(B1)|(A1)|(B1)|(A2)|(B2)|(A1)|(A1)|(A2)|(B2)|(A1)|(B2)|(A1)|(B1)|(A2)|(B2)|(A2)|(B2)|(B1)|(B2)|(B1)|(A1)|(A2)|(A1)|(B1)|(A1)|(B2)|(B1)|(A1)|(B2)|(A1)|(A1)|(B2)|(A1)|(B1)|(B1)|(A2)|(A1)|(A2)|(B1)|(A2)|(B2)|(B2)|(B1)|(A1)|(B1)|(B2)|(A1)|(A2)|(A2)|(B1)|(A1)|(A2)|(A1)|(A1)|(B1)|(A2)|(B2)|(A2)|(A1)|(B1)|(B2)|(A1)|(B1)|(B2)|(A1)|(B2)|(A2)|(B1)|(A1)|(B2)|(B2)|(A2)|(B1)|(A1)|(A1)|(B2)|(B1)|(A2)|(B2)|(A1)|(B1)|(A1)|(B2)|(B2)|(A1)|(B2)|(A2)|(B2)|(A1)|(A1)|(A2)|(B1)|(B2)|(A1)|(B1)|(B2)|(A2)|(B2)|(B1)|(B1)|(A1)|(B2)|(A1)|(A2)|(A1)|(B1)|(B2)|(B2)|(A1)|(A2)|(B2)|(A2)|(A2)|(A2)|(B1)|(A1)|(B2)|(B1)|(B2)|(B1)|(A2)|(A1)|(A1)|(B2)|(A2)|(A1)|(B2)|(B2)|(A1)|(A2)|(B2)|(B1)|(A1)|(B2)|(A1)|(B2)|(A1)|(A2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A2)|(B1)|(B2)|(A1)|(A1)|(B2)|(B2)|(A2)|(B1)|(A2)|(B1)|(B2)|(B1)|(A1)|(A1)|(A2)|(B2)|(B1)|(A1)|(B2)|(A2)|(A1)|(B2)|(A1)|(A2)|(B2)|(A1)|(B2)|(A1)|(A2)|(A2)|(B2)|(B2)|(B2)|(B2)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(A1)|(B2)|(B2)|(B2)|(B1)|(B1)|(B2)|(A2)|(B1)|(A2)|(A2)|(A1)|(A1)|(B2)|(A1)|(B1)|(B1)|(A2)|(B1)|(A1)|(A2)|(A1)|(B2)|(A2)|(A1)|(B2)|(B2)|(B1)|(A1)|(B1)|(B2)|(A2)|(A1)|(A1)|(B1)|(B2)|(A2)|(B2)|(A1)|(A1)|(A2)|(B2)|(B2)|(B2)|(A1)|(B1)|(B1)|(A2)|(B2)|(B1)|(A1)|(A2)|(B2)|(A1)|(A2)|(B2)|(A1)|(A1)|(A1)|(B2)|(B2)|(A1)|(B2)|(B2)|(B2)|(B1)|(B1)|(A2)|(B1)|(A2)|(A1)|(A2)|(A1)|(A1)|(B2)|(B2)|(B2)|(B1)|(B1)|(A2)|(B1)|(A2)|(A2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2) Closed 1 1 1 -980.511431010714 -980.594771361783 -0.083340351070 -980.649479738776 -0.054708376992 -980.693091510982 -0.043611772207 -980.698464571648 -0.005373060666 -980.698561310257 -0.000096738609 -980.698575038376 -0.000013728119 -980.698576830425 -0.000001792048 -980.698577220071 -0.000000389647 -980.698577277685 -0.000000057614 -980.698577292036 -0.000000014350 -980.698577293015 -0.000000000979 -980.698577293038 -0.000000000024 -980.698577293013 0.000000000025 -980.698577293 14 9.797191235163e+02 -4.531913001284e+03 1.464387639251e+03 Using DIIS extrapolation, IDIIS= 1040. NGot= 8053063680 LenX= 8052203874 LenY= 8051788494 Requested convergence on RMS density matrix=1.00D-08 within 128 cycles. Requested convergence on MAX density matrix=1.00D-06. Requested convergence on energy=1.00D-06. No special actions if energy rises. Fock matrices will be formed incrementally for 20 cycles. PT559.900S 2025-12-14T22:24:26.000 -24.31236 -24.31231 -24.30983 -24.30981 -24.30484 -24.30480 -10.16540 -10.16488 -10.16153 -10.16101 -10.16092 -10.16080 -10.09822 -10.09770 -10.08174 -10.08161 -1.32505 -1.31472 -1.31377 -1.30444 -1.29769 -1.29619 -0.98060 -0.92414 -0.86418 -0.83273 -0.81655 -0.74132 -0.73127 -0.71195 -0.66797 -0.66207 -0.66062 -0.62786 -0.62340 -0.61384 -0.60245 -0.59565 -0.58218 -0.57441 -0.57355 -0.55491 -0.55076 -0.54568 -0.54253 -0.52671 -0.51258 -0.51127 -0.49989 -0.47779 -0.46299 -0.45248 -0.44757 -0.43327 -0.38631 -0.35707 -0.30606 -0.28106 -0.05231 -0.02283 0.01454 0.02149 0.04531 0.04804 0.06000 0.08230 0.08439 0.08748 0.09876 0.10908 0.11969 0.12041 0.12050 0.12145 0.12905 0.13124 0.13772 0.14807 0.15196 0.15494 0.15724 0.15881 0.17429 0.17660 0.18076 0.19045 0.19147 0.19236 0.20290 0.20967 0.21354 0.21409 0.22689 0.23616 0.23867 0.24409 0.24780 0.25220 0.25608 0.26780 0.27045 0.28196 0.28808 0.29313 0.29828 0.30002 0.31309 0.32027 0.32089 0.32102 0.32647 0.32940 0.33222 0.35859 0.36078 0.36473 0.36627 0.37585 0.38272 0.38309 0.38727 0.39445 0.39806 0.41344 0.41612 0.41905 0.43050 0.43185 0.43403 0.43446 0.44307 0.45272 0.45493 0.46093 0.46901 0.47096 0.48085 0.50004 0.50492 0.51739 0.53922 0.54845 0.55043 0.55486 0.55492 0.55952 0.56474 0.57541 0.58186 0.58831 0.59162 0.59723 0.60766 0.60920 0.62283 0.62559 0.63067 0.63180 0.64001 0.64036 0.68401 0.69569 0.70538 0.70685 0.71106 0.72457 0.72963 0.74650 0.74676 0.75124 0.75925 0.78510 0.78838 0.79748 0.80907 0.81501 0.82681 0.83207 0.84634 0.84652 0.87020 0.87119 0.88342 0.89889 0.91669 0.91771 0.93277 0.94934 0.97127 0.99917 1.00045 1.00909 1.02978 1.03545 1.06307 1.07156 1.08862 1.09914 1.11305 1.13936 1.15101 1.16412 1.17254 1.19482 1.20012 1.20170 1.23619 1.24241 1.24884 1.26371 1.26489 1.26523 1.31562 1.33053 1.33808 1.35358 1.36323 1.36486 1.36599 1.37808 1.38750 1.38869 1.39251 1.39561 1.41157 1.41465 1.41716 1.43153 1.44306 1.45177 1.46373 1.46472 1.48508 1.49910 1.52366 1.52908 1.53715 1.54634 1.56733 1.57067 1.57703 1.57724 1.58978 1.59809 1.61558 1.64073 1.66225 1.67601 1.67916 1.70513 1.72783 1.73006 1.77112 1.78059 1.81074 1.87277 1.88208 1.92339 1.92483 1.96420 1.96905 2.00195 2.02365 2.02734 2.03690 2.03800 2.06892 2.10030 2.13460 2.14825 2.15748 2.18502 2.22154 2.22203 2.22928 2.23892 2.25748 2.27723 2.29633 2.33078 2.34590 2.37497 2.39313 2.42478 2.45956 2.47156 2.47198 2.50434 2.51510 2.52611 2.52696 2.55009 2.58765 2.60421 2.62513 2.62839 2.64985 2.66015 2.66972 2.67924 2.68426 2.68867 2.70652 2.70951 2.71834 2.73403 2.73532 2.74290 2.74562 2.75298 2.75814 2.76877 2.79506 2.79963 2.80550 2.80990 2.83571 2.85391 2.87340 2.88798 2.88985 2.89624 2.91121 2.92377 2.92783 2.92834 2.96047 2.96305 2.97704 2.98281 2.99763 2.99949 3.00983 3.01747 3.02828 3.03587 3.03690 3.03800 3.05937 3.07182 3.08147 3.08206 3.08786 3.11470 3.12523 3.12937 3.15808 3.16897 3.19491 3.21148 3.21791 3.22297 3.22456 3.24271 3.25611 3.27544 3.28072 3.29444 3.30451 3.30839 3.33292 3.34884 3.35551 3.38237 3.39255 3.39439 3.41765 3.41949 3.42336 3.44020 3.44939 3.48978 3.49029 3.49332 3.50061 3.51824 3.53003 3.53593 3.54535 3.54544 3.55337 3.58872 3.60200 3.61015 3.62323 3.63359 3.63494 3.67827 3.73505 3.73871 3.74214 3.76955 3.77498 3.82350 3.82933 3.83438 3.86790 3.87191 3.90200 3.90429 3.91807 3.97283 3.97297 3.99485 4.01342 4.02201 4.07827 4.08359 4.12058 4.13216 4.13996 4.19744 4.20651 4.23101 4.23871 4.24207 4.25979 4.26209 4.26214 4.27002 4.29098 4.29753 4.32421 4.33578 4.36155 4.36163 4.40947 4.44436 4.45941 4.48279 4.49127 4.54337 4.55429 4.56893 4.63753 4.65962 4.75573 4.75608 4.78293 4.79745 4.87153 4.91543 5.01904 5.04302 5.06411 5.20066 5.20883 5.25124 5.30053 5.30060 5.40504 5.57643 5.68943 5.72456 6.07177 6.14505 6.17620 6.20078 6.21501 6.24438 6.26572 6.28678 6.29498 6.32204 6.37575 6.41765 6.48693 6.48985 6.49315 6.49350 6.49414 6.50177 6.50489 6.50659 6.50710 6.51343 6.52402 6.55655 6.55895 6.57289 6.58323 6.58693 6.59604 6.62372 6.63783 6.64340 6.64700 6.67437 6.67454 6.69039 6.70597 6.70954 6.73493 6.76367 6.77407 6.86089 6.86111 6.89704 6.89886 6.95749 6.98911 7.00696 7.03279 7.09188 7.11217 7.11422 7.19925 7.35093 7.38206 7.45691 7.46730 7.54651 7.61179 7.69173 7.77412 7.86349 8.84743 8.86252 8.86580 8.88561 8.91315 8.94120 8.94745 8.96151 8.97317 8.97866 8.99863 9.03589 9.18326 9.21609 9.23009 9.28947 9.31469 9.36666 9.37526 9.40740 9.47958 9.50376 9.57619 9.64843 9.65102 9.68742 9.74777 9.77858 9.82180 9.90556 22.78187 23.07981 23.41456 23.46643 23.47401 23.59146 23.60971 23.69695 23.91973 24.05745 63.55199 63.57845 63.59948 63.62695 63.64199 63.69148 1-A1. Mulliken charges: 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 C C C C C C C C C C F F F F F F H H 0.057486 0.057486 -0.109991 0.006527 -0.109991 0.006527 0.429138 -0.015912 0.429138 -0.015912 -0.231419 -0.231419 -0.182554 -0.201385 -0.182554 -0.201385 0.248111 0.248111 -0.00000 1-A1. -0.0000 0.0000 0.4685 0.4685 -83.9633 -87.6092 -98.8351 -0.0000 0.0000 -0.0000 6.1726 2.5266 -8.6992 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -26.7871 -0.0000 -0.0000 -5.5362 -0.0000 -0.0000 10.6819 0.0000 -78.4331 -1121.0639 -2869.8729 -0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 -195.8308 -432.5304 -655.1593 -0.0000 0.0000 -0.0000 (B1)|(A2)|(A1)|(B1)|(A1)|(B2)|(A1)|(B2)|(A1)|(B1)|(A2)|(A1)|(B1)|(A1)|(B2)|(A2)|(A1)|(B2)|(A1)|(B2)|(B2)|(A2)|(A1)|(B1)|(A1)|(B2)|(B1)|(B2)|(A2)|(A1)|(B1)|(B2)|(A2)|(A1)|(A1)|(B2)|(A1)|(A2)|(A2)|(B2)|(A1)|(A1)|(B2)|(B2)|(A1)|(B2)|(B2)|(A1)|(B2)|(B2)|(B1)|(A1)|(A1)|(B2)|(A1)|(B1)|(A1)|(B2)|(B2)|(A1)|(A2)|(A1)|(B2)|(A1)|(B2)|(A1)|(B1)|(B2)|(A2)|(A1)|(B2)|(A1)|(A1)|(B2)|(A1)|(A2)|(B2)|(B1)|(A1)|(B1)|(B2)|(A1)|(B2)|(B1)|(B2)|(A1)|(B1)|(B2)|(B2)|(B1)|(A1)|(A1)|(A2)|(A2)|(B2)|(B1)|(A1)|(B2)|(A1)|(B1)|(A2)|(B2)|(A2)|(B1)|(A1)|(B2)|(A1)|(B1)|(B2)|(B2)|(A1)|(A2)|(A1)|(A1)|(B2)|(B2)|(A2)|(A1)|(B1)|(B2)|(A1)|(A2)|(A1)|(B2)|(B1)|(A1)|(B2)|(A2)|(A1)|(B2)|(B2)|(A1)|(B1)|(B2)|(A1)|(A2)|(A1)|(B2)|(A1)|(A2)|(B2)|(A1)|(B1)|(B1)|(A1)|(B2)|(A1)|(A2)|(A2)|(B2)|(B1)|(B2)|(B2)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(B1)|(A2)|(A2)|(B1)|(A1)|(B2)|(B2)|(A1)|(B2)|(B1)|(A2)|(B2)|(B1)|(A1)|(A2)|(A2)|(A1)|(B2)|(A1)|(A1)|(A1)|(B2)|(A1)|(B2)|(A2)|(B2)|(A1)|(A2)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(B2)|(B2)|(B2)|(A1)|(B2)|(B2)|(B2)|(A1)|(B1)|(A1)|(B1)|(B2)|(A1)|(A2)|(B1)|(B1)|(A1)|(B1)|(A2)|(B2)|(A1)|(A1)|(A2)|(B2)|(A1)|(B2)|(A1)|(B1)|(A2)|(B2)|(A2)|(B2)|(B1)|(B1)|(B2)|(A1)|(A1)|(A2)|(A1)|(B1)|(B2)|(B1)|(A1)|(B2)|(A1)|(A1)|(B1)|(B2)|(A1)|(A2)|(B1)|(B1)|(A2)|(A1)|(A2)|(B1)|(A1)|(B2)|(B2)|(B1)|(A1)|(B2)|(B1)|(A2)|(A2)|(A1)|(A2)|(A1)|(B1)|(A1)|(A2)|(B2)|(B1)|(A1)|(A2)|(A1)|(B1)|(B2)|(A1)|(B1)|(B2)|(A2)|(B2)|(A1)|(B1)|(A2)|(B2)|(B2)|(A1)|(A1)|(B2)|(B1)|(A2)|(A1)|(B2)|(B1)|(A1)|(B2)|(A1)|(B2)|(A2)|(B2)|(B2)|(A1)|(A2)|(B1)|(A1)|(B1)|(B2)|(A1)|(A2)|(B2)|(B1)|(B1)|(B2)|(A2)|(A1)|(B2)|(B1)|(A1)|(A1)|(B2)|(B2)|(A2)|(A2)|(A1)|(A2)|(B1)|(B2)|(A2)|(A1)|(B1)|(B2)|(B2)|(B1)|(A2)|(A1)|(A2)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A2)|(B1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A2)|(A1)|(A1)|(B2)|(B2)|(A1)|(A1)|(A2)|(B1)|(B2)|(A1)|(B2)|(A2)|(A1)|(B2)|(A2)|(B1)|(B1)|(B1)|(B2)|(A2)|(A1)|(A1)|(B2)|(B1)|(A1)|(A2)|(B2)|(A1)|(B2)|(A1)|(A2)|(B2)|(A1)|(B2)|(A2)|(A2)|(A1)|(B2)|(B2)|(B2)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A1)|(B2)|(B2)|(B2)|(B2)|(B1)|(B1)|(A2)|(B1)|(A2)|(A2)|(A1)|(A1)|(B2)|(A1)|(B1)|(A2)|(B1)|(B1)|(A1)|(B2)|(A2)|(A2)|(A1)|(A1)|(B2)|(B2)|(B1)|(A1)|(B2)|(B1)|(A2)|(A1)|(A1)|(B1)|(B2)|(A2)|(B2)|(A1)|(A1)|(A2)|(B2)|(B2)|(B2)|(B1)|(A1)|(A2)|(B1)|(B2)|(B1)|(A1)|(A2)|(B2)|(A2)|(A1)|(B2)|(A1)|(A1)|(A1)|(B2)|(B2)|(A1)|(B2)|(B2)|(B2)|(B1)|(B1)|(A2)|(B1)|(A2)|(A1)|(A2)|(A1)|(A1)|(B2)|(B2)|(B2)|(B1)|(B1)|(A2)|(B1)|(A2)|(A2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(B2)|(A1)|(B2)|(A1)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2) (B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(A1)|(B2)|(B2)|(A1)|(A1)|(B2)|(A1)|(B2)|(A1)|(B2)|(A1)|(A1)|(A1)|(B2)|(A1)|(B2)|(B2)|(B1)|(A1)|(B1)|(A1)|(A2)|(B1)|(B2)|(A2)|(A2)|(B2)|(A1)|(B2)|(B2)|(A1)|(B1)|(A1)|(B2)|(A1)|(B1)|(A2)|(B1)|(A2) GINC-AMD23 OCHARAPALE 2025-12-14T00:00:00.000 0 6F_isomer_71 opt 0 1 Version=ES64L-G16RevC.02 State=1-A1 HF=-980.6985773 RMSD=6.413e-09 Dipole=-0.1843249,0.,0. Quadrupole=-6.4676471,1.8784932,4.5891539,0.,0.,0. PG=C02V [SGV(C10H2F6)] 0 -0.17578 -0.704768 0. 0 -0.17578 0.704768 0. 0 1.052946 1.379536 0. 0 -1.397948 -1.399477 0. 0 1.052946 -1.379536 0. 0 -1.397948 1.399477 0. 0 2.226304 0.701059 0. 0 -2.555217 -0.702021 0. 0 2.226304 -0.701059 0. 0 -2.555217 0.702021 0. 0 1.065313 2.696484 0. 0 1.065313 -2.696484 0. 0 -3.717312 -1.316303 0. 0 3.376238 1.328709 0. 0 -3.717312 1.316303 0. 0 3.376238 -1.328709 0. 0 -1.419985 -2.476398 0. 0 -1.419985 2.476398 0.