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C 3.05202502 -1.12463528 0.98094425
C 3.14732412 -1.42511581 ... |
optimized_conformer_242.xyz | 84
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C 1.30691571 -0.38742247 3.02799593
C 3.07796824 -1.23865846 0.99112846
C 3.18077822 -1.54086530 ... |
optimized_conformer_243.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 3.16357470 -1.13098844 0.99294563
C 3.26308646 -1.43275735 ... |
optimized_conformer_244.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.17293339 0.62000612 2.46194918
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C 3.05211296 -1.12469990 0.98108604
C 3.14729136 -1.42511525 ... |
optimized_conformer_245.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.19117302 0.51111213 2.46202905
C 3.09626698 0.07447772 1.41960923
C 1.30691460 -0.38742418 3.02799626
C 3.07796781 -1.23866025 0.99112800
C 3.18077607 -1.54086694 ... |
optimized_conformer_246.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 1.39656572 -0.28457440 3.03513165
C 3.16357271 -1.13098438 0.99292798
C 3.26310168 -1.43275798 ... |
optimized_conformer_247.xyz | 84
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C 3.14722772 -1.42509164 ... |
optimized_conformer_248.xyz | 84
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C 1.30691886 -0.38741679 3.02799821
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C 3.18078457 -1.54086140 ... |
optimized_conformer_249.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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optimized_conformer_25.xyz | 84
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C 3.09758217 -1.08142743 0.98702871
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optimized_conformer_250.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.27728377 0.61610364 2.46575998
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C 3.16357445 -1.13098822 0.99294444
C 3.26308705 -1.43275642 ... |
optimized_conformer_251.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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optimized_conformer_252.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 3.07796828 -1.23865790 0.99112793
C 3.18077761 -1.54086562 ... |
optimized_conformer_253.xyz | 84
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C 1.39656451 -0.28457658 3.03513178
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C 3.26310132 -1.43276004 ... |
optimized_conformer_254.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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optimized_conformer_255.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 3.10891295 -1.25889672 0.88823926
C 3.18649407 -1.55735563 ... |
optimized_conformer_256.xyz | 84
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C 0.95899224 -0.06321494 3.17430312
C 2.90277693 -1.04562064 1.31360509
C 3.06844873 -1.40028331 ... |
optimized_conformer_257.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 1.96234167 0.57778417 2.53351158
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C 1.08354795 -0.32355571 3.09919330
C 2.87657704 -1.17137679 1.07887022
C 2.99446733 -1.47985607 ... |
optimized_conformer_258.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.23401653 0.49470597 2.46085036
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C 3.11046078 -1.25314614 0.98109853
C 3.19874055 -1.55518005 ... |
optimized_conformer_259.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.15818210 0.62023825 2.44363093
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C 1.28305007 -0.28813862 3.00341824
C 3.04496094 -1.10962229 0.94997995
C 3.13773377 -1.39911949 ... |
optimized_conformer_26.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 1.42148596 -0.41624155 2.93848949
C 3.30941784 -0.82866560 0.86004796
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optimized_conformer_260.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 3.05167653 -1.12446181 0.98039702
C 3.14727770 -1.42509692 ... |
optimized_conformer_261.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 1.14586083 -0.35800726 3.10157575
C 2.92748698 -1.20405762 1.07071110
C 3.03422190 -1.51115364 ... |
optimized_conformer_262.xyz | 84
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C 1.32235319 -0.36702721 3.07922460
C 3.09744289 -1.22284862 1.04686590
C 3.19829170 -1.53576847 ... |
optimized_conformer_263.xyz | 84
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C 3.04445633 -1.17830489 1.02682628
C 3.15255373 -1.46636630 ... |
optimized_conformer_264.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 1.26308038 -0.39146452 3.08393254
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C 3.09976199 -1.53967176 ... |
optimized_conformer_265.xyz | 84
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C 3.11798673 -1.25838594 1.05438219
C 3.20711842 -1.55371367 ... |
optimized_conformer_266.xyz | 84
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C 2.19586677 0.53192637 2.53277848
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C 1.31590283 -0.37404978 3.09011265
C 3.09278466 -1.20210828 1.05110380
C 3.19668272 -1.49328478 ... |
optimized_conformer_267.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.18630275 0.55149979 2.52972702
C 3.08422041 0.11429674 1.48203056
C 1.31049478 -0.34673540 3.10754792
C 3.06685882 -1.20114337 1.06046246
C 3.15643250 -1.50940260 ... |
optimized_conformer_268.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.19109610 0.49047611 2.55746906
C 3.09720248 0.06228600 1.51175535
C 1.31171396 -0.41378593 3.12058178
C 3.08232024 -1.24958103 1.07843040
C 3.18143849 -1.54702805 ... |
optimized_conformer_269.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.28066614 0.52286983 2.52933260
C 3.18123065 0.09093952 1.48088349
C 1.40413658 -0.37855937 3.10169698
C 3.16395807 -1.22203733 1.05176860
C 3.25607219 -1.52360767 ... |
optimized_conformer_27.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.52468771 0.97532670 2.27612076
C 3.37022242 0.46770772 1.21554450
C 1.64803580 0.12435628 2.92170777
C 3.31519596 -0.86492474 0.86000286
C 3.33011354 -1.24272162 ... |
optimized_conformer_270.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
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C 3.06638777 0.15269597 1.52188450
C 1.26009582 -0.31429828 3.11032390
C 3.06004646 -1.16266257 1.09848750
C 3.17866100 -1.47024895 ... |
optimized_conformer_271.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.19117478 0.51111434 2.46203402
C 3.09626782 0.07448196 1.41961112
C 1.30691585 -0.38742128 3.02799770
C 3.07796866 -1.23865581 0.99112834
C 3.18077895 -1.54086476 ... |
optimized_conformer_272.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.21126843 0.48116672 2.49384895
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C 1.33581720 -0.42158661 3.06518520
C 3.09241505 -1.26055537 1.01207493
C 3.18200203 -1.55946884 ... |
optimized_conformer_273.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.33820786 0.50393550 2.53110868
C 3.23514373 0.06205049 1.48404253
C 1.45612733 -0.38914611 3.10829494
C 3.20891237 -1.25272875 1.06107060
C 3.30039140 -1.56140278 ... |
optimized_conformer_274.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.25407897 0.59948189 2.47379868
C 3.15752161 0.16180187 1.43077374
C 1.37160842 -0.29943240 3.04300445
C 3.13974241 -1.15282950 1.00587263
C 3.23967919 -1.45814479 ... |
optimized_conformer_275.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.24386324 0.50202237 2.43682596
C 3.13937644 0.06908876 1.38496127
C 1.37167312 -0.39947579 3.01510909
C 3.12459190 -1.24602136 0.96187472
C 3.21184656 -1.55121468 ... |
optimized_conformer_276.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.34841362 0.48622858 2.53529533
C 3.25645679 0.05494170 1.49304461
C 1.46603102 -0.41523222 3.09988317
C 3.24259868 -1.25754302 1.06285025
C 3.34998530 -1.55700446 ... |
optimized_conformer_277.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.29125746 0.65369897 2.44414101
C 3.19416170 0.20587257 1.40415374
C 1.40234831 -0.23544578 3.01821016
C 3.16825083 -1.11041334 0.98595904
C 3.26685921 -1.42473170 ... |
optimized_conformer_278.xyz | 84
Properties=species:S:1:pos:R:3 charge=0 spin=0 pbc="F F F"
C 2.24550833 0.50767118 2.39802224
C 3.14555108 0.06817074 1.35254503
C 1.36311631 -0.38863282 2.97100379
C 3.12431516 -1.24663325 0.92864012
C 3.22000140 -1.55416107 ... |
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