32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=255.699148288 stress="-8.147329636552243 0.2043357460113243 -0.03606408830682687 0.2043357460113243 -7.572092181910169 0.2834497291814692 -0.03606408830682687 0.2834497291814692 -8.532392910336034" pbc="F F F" Mo -0.15379940 0.01821382 -0.26185792 -6.23557131 -6.03983112 -6.40453590 U 1.46963223 1.89991175 -0.09604453 -11.59949492 -6.69735744 -49.99092819 Mo 1.33226600 -0.26950400 1.62036030 -9.98417517 -29.32939316 -18.30990146 U -0.04368752 1.61654609 1.64432661 -37.77025346 -0.80641974 -18.12090883 U 2.76023492 0.24849743 0.25911890 13.57266720 -34.08568311 -34.16212871 Mo 4.69019325 1.82815389 0.10881314 9.61809385 1.31647301 -11.32259692 U 4.63250256 0.10031152 1.55442580 23.53272878 -23.40504356 -4.43598261 Mo 2.61249955 1.37131357 1.43213005 10.99259463 -1.88727078 1.43995926 Mo 0.05791531 2.73387496 0.08501927 -24.74548188 11.80988312 -22.45146506 U 1.78059630 4.50693356 0.16501753 -28.14515665 29.81962751 -44.78127967 U 1.72580078 2.92866320 1.68883157 -33.63633429 -4.47844761 -11.76081056 U -0.00044125 4.54313966 1.72745816 -32.86937566 25.97378143 -31.28284680 Mo 3.25980354 2.96667242 0.27143892 20.65491085 -18.90501370 -23.99972942 U 4.40295338 4.60338854 0.24759167 34.04475407 31.58634387 -34.68622619 Mo 4.61018303 2.92518197 1.09927198 15.17027902 -15.50239236 0.56027105 U 2.98702489 4.44857885 1.68843096 19.72489361 64.40172990 17.70685791 U 0.17061300 0.29169807 2.96863002 -49.32749748 -29.86881485 -3.44439788 Mo 1.63123179 1.53851086 3.14982991 -1.69394225 11.58154706 12.95549484 U 1.24795387 -0.17070544 4.28747849 -3.81291246 -46.78261233 62.65506196 Mo -0.10523254 1.37993804 4.78095696 -15.66148083 10.54417677 19.60013504 U 2.65642761 0.26008946 2.87675974 28.98233734 -33.65944949 -12.18968262 Mo 4.32230465 1.78460712 2.63670297 20.84704523 8.65582563 1.89256270 U 4.26772449 -0.22284313 4.24014891 18.55657179 -8.40187113 14.76109229 Mo 2.69391305 1.32743118 4.29546282 7.32862449 10.20384195 27.02807611 Mo -0.29059379 3.08384912 2.72956938 -27.60662063 -5.93334069 10.86097182 U 1.33885520 4.53926819 3.23010044 23.70663204 49.59591565 -9.85856283 Mo 1.35827064 3.12528982 4.62033173 -3.55450976 -20.05991255 26.26001916 U 0.17828948 4.71182891 4.29301824 -52.89729052 23.77501571 47.12233831 U 2.73241985 3.07255377 3.01129231 46.40697362 -16.81482800 44.13943819 Mo 4.51258782 4.66911338 2.80454100 19.07966460 11.26792298 10.88152703 Mo 4.62365747 3.07851838 4.45297513 13.00408756 0.43402597 13.44943339 Mo 2.84681875 4.36894099 4.54737131 14.31723855 11.69157106 25.88874460