No title 1.00000000000000 20.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 15.0000000000000000 0.0000000000000000 0.0000000000000000 0.0000000000000000 15.0000000000000000 Si O C H 1 2 4 13 Selective dynamics Direct 0.3567313599999977 0.4766153599999967 0.4747995600000010 T T T 0.4203423700000002 0.5224384999999998 0.5233632999999998 T T T 0.3370885000000001 0.3721435000000000 0.5049657499999967 T T T 0.5489798300000004 0.4862385599999968 0.4883398999999997 T T T 0.2774394400000020 0.5455467700000014 0.5001397400000016 T T T 0.3674840099999983 0.3253332000000029 0.5768066500000018 T T T 0.3680424499999972 0.4694051800000025 0.3498852199999973 T T T 0.5569133899999983 0.4272666299999983 0.5260624599999986 T T T 0.5547087099999999 0.4844411099999988 0.4135381299999992 T T T 0.6840312699999984 0.5216584200000014 0.4766524400000023 F F F 0.2337744700000002 0.5135563799999971 0.4688732500000015 T T T 0.2700358100000031 0.5493427600000018 0.5727241199999966 T T T 0.2845355199999986 0.6131388399999977 0.4730590400000025 T T T 0.3752903500000002 0.2555200500000012 0.5563883399999980 T T T 0.4158462500000013 0.3551754399999965 0.5964005599999993 T T T 0.3341248300000004 0.3256275800000026 0.6355063500000000 T T T 0.3738813499999978 0.5369246300000015 0.3224738500000015 T T T 0.4135496800000027 0.4307021500000019 0.3367044000000021 T T T 0.3250564599999990 0.4359160699999975 0.3188883700000034 T T T 0.5236523299999973 0.5461303800000010 0.5189014600000021 T T T 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00 0.00000000E+00