@< path("EquilibriumCrystalStructure__TD_457028483760_001") >@ 
C H N O
AB4C4D2_oF176_43_b_4b_4b_2b
a b/a c/a x1 y1 z1 x2 y2 z2 x3 y3 z3 x4 y4 z4 x5 y5 z5 x6 y6 z6 x7 y7 z7 x8 y8 z8 x9 y9 z9 x10 y10 z10 x11 y11 z11
standard
1
27.1759 0.5943759 0.15310624 0.37471021 0.44852943 0.86279886 0.31277539 0.51410753 0.026203689 0.36926555 0.54943366 0.16090229 0.4423825 0.48337049 0.020974118 0.44404683 0.40209987 0.73568824 0.35041268 0.50624389 0.024474326 0.42367161 0.4441945 0.87383173 0.3538587 0.38665619 0.6700327 0.30814632 0.3722095 0.62088071 0.27553954 0.42177651 0.77372297 0.47732332 0.34918462 0.44202619
@< MODELNAME >@