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:Z:I:1:forces:R:3 energy=2239.22449375 pbc="F F F" Xe 0.38405506 -0.12769823 0.00899399 54 -416.53744453 -329.51370421 -634.75400442 He 1.40070299 1.22335075 0.26845851 2 102.89984375 162.77378445 14.01835063 Ar 1.51058494 -0.08808213 1.69290514 18 216.57543043 -1083.04444249 -161.35767751 Ar 0.08021488 1.31483532 1.56794969 18 -996.45044068 123.95708076 -467.08204894 Xe 3.04616062 0.09495616 -0.02013467 54 -78.05446845 -39.20397237 -275.55223939 He 4.32336649 1.66610545 0.09591634 2 8.82520850 -7.52182510 -27.33853417 C 4.50719707 0.17826051 1.37585447 6 288.93772556 10.41808832 82.17634755 He 3.17866850 1.90112877 1.08876865 2 -0.18971426 -53.04338235 -1.55347037 H 0.16724888 2.69068970 0.09243325 1 -5.39236652 -6.85913407 -24.13641633 He 1.04417291 4.77166534 -0.24939811 2 21.64275360 13.52490122 -58.24658222 Ar 1.77799716 2.74846459 1.55078539 18 430.76018906 3435.92360698 -3656.04247622 Xe 0.41068332 4.37755775 1.45395664 54 -195.24765268 344.67854247 -103.92766295 H 3.03549295 2.97829224 0.13723811 1 -20.55152065 7.94371814 -51.05505482 Xe 4.44193771 4.67423387 -0.07268410 54 35.33239073 337.63938463 -377.30082117 Xe 4.68827503 3.00622260 1.45784434 54 363.71851660 -587.58801255 -122.51094225 C 3.11420803 4.41588747 1.61195569 6 -151.29413107 178.79110412 37.94030393 C -0.16774520 -0.13855592 3.13873685 6 -31.19477507 -23.68008085 43.84579518 Xe 1.60857204 1.51771253 2.71209277 54 64.41719927 -2932.73484516 4327.45035165 He 2.06607657 0.19630060 4.60388578 2 -180.43866878 -185.69644708 -28.33975022 C 0.06301026 1.28318947 4.08833062 6 -144.48554313 -35.16057865 119.36708009 Ar 3.27391104 0.10761499 2.82853686 18 70.80715889 -117.58159962 78.43181752 He 4.53971162 1.86253962 3.03691865 2 7.59558414 -24.66874954 27.22707670 C 4.27587589 -0.08338798 4.51264684 6 47.76984194 -9.20148187 79.43849951 H 2.89737457 1.04792645 4.75262407 1 182.09911315 183.34832389 39.98455573 H -0.01238960 2.99121780 2.60052633 1 -62.67527128 -107.00536455 121.39894179 C 1.76583899 4.45167692 3.26813877 6 -123.52378838 344.30424970 -263.32158484 Ar 1.74028772 2.98162287 4.26393696 18 -296.25830927 -153.23353038 673.09673092 H 0.01729864 4.38675382 4.31995713 1 -2.57240686 2.01978112 0.49093213 Ar 3.03208261 2.96755807 2.94090796 18 684.45184688 177.01093100 130.97354144 C 4.59257776 4.22543011 2.98942593 6 41.25307665 300.14803675 319.08726201 H 4.21104604 3.19776383 4.63819860 1 14.71619207 -10.81374360 6.29497374 Ar 2.95923342 4.72870264 4.69130138 18 123.06443040 84.06936090 151.29670530