64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-96.81638964213121 stress="6.069030155720173e-05 -5.538776524658402e-06 1.3335453167433182e-05 -5.538776524658402e-06 4.102223784980818e-05 1.378802524103849e-05 1.3335453167433182e-05 1.378802524103849e-05 9.521351856182224e-05" pbc="F F F" H 35.08729927 35.18115092 34.80576493 0.70612405 0.62218735 1.06254880 Ni 36.39128637 36.13050712 36.43962069 0.51470504 0.02031194 -1.90027892 H 37.75344140 37.10643203 35.08911741 -0.00976120 0.19383354 0.28798798 Ni 38.47954822 38.77705464 35.78803348 -0.50828163 -0.73594514 0.76293632 Ni 37.29184354 34.83677822 37.80726884 0.37962430 0.34422434 0.71565397 H 38.48680339 36.34137219 39.11442042 0.01440327 -0.26392022 -0.12536436 Ni 34.92206872 37.36984979 37.16650106 -0.24357268 1.54106106 0.55337072 Ni 36.11467248 39.14216108 38.63359262 3.15477416 -2.24293403 -1.55372227 H 39.79927858 35.22307255 34.98000011 1.55470515 1.05722663 2.19473394 H 40.77299140 35.63840156 35.91888713 -1.61950318 -0.05744258 -1.32747792 H 42.18605241 36.90947177 35.29354517 0.34696030 0.48417222 0.61753103 Ni 43.84384632 38.63691428 35.97883592 -1.09687317 -1.27582780 0.14745755 H 41.79862435 34.97643891 37.59882428 0.28489524 0.42643325 0.41744578 Ni 44.00578277 35.54597453 38.79660490 -1.25966605 0.35076194 -0.51734767 H 40.40552930 37.26931925 37.13831804 -0.33997015 -0.21723017 -0.33230599 H 41.47437362 38.82639977 39.52237283 0.21862481 -0.29072571 0.36680309 Ni 34.75907682 39.75557516 34.98908486 -0.40597731 -1.18629103 0.13257038 Ni 36.03346884 40.71031432 36.18443433 1.35900429 0.39589034 1.42215705 H 37.01811091 41.75791973 34.70027899 -0.27369047 -0.30222511 0.47575195 Ni 38.34423512 43.46830049 36.11189619 0.30815079 -0.51602886 0.59541183 H 37.65380906 39.37683722 37.67535533 0.14846729 -0.09626904 -0.09765880 H 38.88775853 40.59626976 38.09905908 -0.15883585 0.05276370 0.02799147 H 34.64781811 42.54819390 37.57144801 0.58016916 -0.40192495 0.23663115 H 35.86447348 43.10853655 38.54268166 -0.05838341 -0.28304790 -0.02555547 H 39.83207618 39.64365191 35.64996236 -0.35280113 -0.29046126 -0.02153956 H 40.75786638 41.32897328 36.74186689 0.12188888 -0.10945564 -0.04296058 H 43.07788109 42.03387856 35.60366787 0.20969560 0.28680438 -0.06065689 Ni 43.96470462 43.43668553 35.62759614 -0.54945641 -0.33235322 0.32671086 H 41.97487195 40.56114768 37.31801028 -0.16745412 0.39404793 0.05747074 H 43.40410107 40.88075104 38.87607868 -0.43758743 0.51951595 0.42403417 Ni 40.85662210 42.72043528 37.39809534 -1.01645491 -1.68432130 -1.78319007 Ni 41.49746725 43.75381990 38.85683713 0.10084784 2.07757083 1.63516505 Ni 34.70631720 35.01373746 40.10553930 0.84081295 0.67559144 -0.18770880 Ni 36.15991824 36.51314895 41.89560672 1.02271868 0.54189455 0.14713015 H 37.03028369 37.46701861 39.56073393 -0.14393366 0.24157562 -0.14092963 Ni 38.94552824 38.25719768 41.57559177 -0.35875800 5.31987149 -6.67763456 H 37.61361428 34.75159377 42.19348881 -0.12483440 0.50177013 0.08893689 Ni 38.43149516 36.46503053 43.64184950 -2.89746520 -0.90041697 1.83735682 H 34.93173548 38.04450961 42.56293556 0.26963449 -0.06655656 0.15914135 Ni 35.79383404 39.20444091 44.00900551 0.78910773 0.08506437 -1.45627290 Ni 40.39311453 35.59589087 40.47742649 -5.94051788 -2.39171321 -4.06082062 Ni 41.64694032 36.20334100 41.25392495 6.10470233 3.32465364 3.59226783 H 42.50940515 37.77799722 39.87207839 -0.30496000 -0.02605904 0.12492837 Ni 43.62988405 39.06495192 41.94165899 -0.90015792 0.72015973 0.67104201 H 42.04799841 35.28635266 43.03174884 0.21223380 0.19391635 -0.06042870 Ni 43.72778845 36.05208472 44.11528808 -0.46475932 0.21259229 -0.57266194 Ni 39.50905976 37.10696437 42.23807910 6.34991713 -7.11454182 2.05290497 H 41.66476694 38.50088899 43.64575180 -0.01734824 -0.10551059 -0.29292215 Ni 34.70218922 40.20313122 39.14327880 -2.00872452 2.49291770 0.66844033 Ni 36.54138070 41.27521663 40.86992394 -1.33896428 -2.21726342 1.22607894 Ni 37.58281451 42.89786233 40.33129035 -2.33049780 -5.20812349 -2.87730769 Ni 38.30415239 44.18399638 40.81341300 4.10747827 5.65821956 2.93032945 Ni 37.62876493 39.36339200 42.11816830 -4.46949084 3.53416629 1.97630954 Ni 38.36250509 41.73031851 43.32304531 -6.48807753 -3.45943806 0.79149295 H 34.53680825 42.02107936 42.98325062 1.07297508 -0.40152509 -0.28009667 H 35.91940571 43.35768052 44.09140490 0.71115293 -0.84229789 -0.86281682 H 39.31219702 39.98409033 39.94452553 -0.09537857 -0.09800823 0.16365658 Ni 41.66650189 41.48165455 41.60640122 -1.50620050 -1.57781536 3.49046574 Ni 42.37501571 42.32230587 40.13196207 2.03965561 0.45304323 -2.29563935 H 42.95812833 43.36599024 41.94820163 -0.37700684 -0.56482013 -0.49890023 H 42.47609528 40.11559798 43.03173677 0.35545791 0.07191002 -0.18942820 H 44.08108167 40.80803265 43.86457661 -0.61217426 -0.52336326 -0.95318922 Ni 39.70353115 42.56773381 42.88885400 5.73966790 3.74776062 -2.44782109 H 41.51162095 43.90274198 44.13894163 -0.74103615 -0.75805533 -0.73820873