../../td/EquilibriumCrystalStructure__TD_457028483760_001/runner 
O Si
A2B_aP12_1_8a_4a
a b/a c/a alpha beta gamma 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 x12 y12 z12
standard
3
4.8148 1.0090554 1.2337792 90.6769 93.4213 104.9604 0.83444658 0.74316558 0.34789913 0.31031066 0.56129773 0.4409883 0.2622917 0.99750129 0.65820089 0.99658833 0.21559092 0.17096706 0.70388831 0.8997527 0.88210274 0.49799755 0.35970518 0.017010708 0.18151059 0.74077863 0.040367867 0.83099114 0.40874711 0.68029927 0.92167637 0.88407129 0.10373225 0.054298238 0.67769524 0.55407388 0.27578218 0.47620465 0.16974965 0.57041835 0.17076969 0.80067824
5.8657 1.2285831 0.88604941 90.2824 90.3358 89.1585 0.41459729 0.0082198577 0.029490745 0.58625089 0.9918205 0.50884854 0.012148495 0.77078629 0.28170374 0.98828716 0.22919128 0.78031836 0.20125141 0.28788392 0.28417671 0.79932241 0.71162227 0.78413436 0.20658201 0.70532472 0.78417706 0.79242869 0.29549605 0.27851723 0.99595039 0.34010478 0.50398068 0.0044277995 0.65861506 0.0050105426 0.0019353736 0.66366922 0.56105863 0.99681808 0.33726605 0.060483403
5.1347 0.82078797 1.4132666 85.4688 90.8162 94.3029 0.26152311 0.036363248 0.47375313 0.31276043 0.7767732 0.35014332 0.91432073 0.44746606 0.523864 0.48075394 0.4523015 0.75993705 0.72084256 0.97188126 0.73971897 0.69888876 0.71358261 0.064416172 0.076492034 0.34730142 0.1688373 0.21668388 0.85548518 0.93675313 0.9768157 0.5784031 0.99226111 0.50670267 0.76834979 0.87917566 0.15030203 0.39754504 0.38406876 0.78917417 0.35432758 0.72707139
Sim_LAMMPS_Buckingham_CarreHorbachIspas_2008_SiO__SM_886641404623_000