../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
H N O
A4B2C3_oP72_56_4e_cde_cd2e
a b/a c/a z1 z2 z3 z4 x5 y5 z5 x6 y6 z6 x7 y7 z7 x8 y8 z8 x9 y9 z9 x10 y10 z10 x11 y11 z11
standard
1
8.0824 0.99703058 1.2400525 0.013900693 0.14238145 0.98868389 0.860206 0.055287547 0.94468342 0.17927352 0.89536165 0.079947238 0.20087739 0.90501958 0.9036304 0.29304731 0.041904719 0.060369034 0.31986719 0.97508682 0.99680853 0.2481071 0.11920312 0.28853587 0.9533161 0.78538817 0.11800799 0.95063541
Sim_LAMMPS_ReaxFF_StrachanVanDuinChakraborty_2003_CHNO__SM_107643900657_001