No title 1.0 20.00000000 0.00000000 0.00000000 0.00000000 15.00000000 0.00000000 0.00000000 0.00000000 15.00000000 N H C Si O 1 22 7 2 4 Direct 0.63850679 0.48549083 0.59689421 # 1 N 0.66056535 0.48065786 0.65832425 # 2 H2 0.67602298 0.47787498 0.55105168 # 3 H3 0.15578222 0.51558469 0.36874462 # 4 H4 0.21400574 0.60642516 0.36549039 # 5 H5 0.22472485 0.51311620 0.29301783 # 6 H6 0.11552993 0.54459756 0.65771276 # 7 H7 0.15405235 0.63340965 0.59723085 # 8 H8 0.11145780 0.54589052 0.53876784 # 9 H9 0.42395651 0.42565407 0.29483891 # 10 H10 0.42434849 0.33611101 0.37353981 # 11 H11 0.35100052 0.40449903 0.36091939 # 12 H12 0.53398330 0.26811201 0.57324643 # 13 H13 0.53678257 0.35176265 0.47740878 # 14 H14 0.60778855 0.43058191 0.59027919 # 15 H15 0.25182065 0.68673913 0.50425063 # 16 H16 0.31032380 0.66396294 0.59002639 # 17 H17 0.33417135 0.65266842 0.47621949 # 18 H18 0.44534598 0.61693487 0.55843172 # 19 H19 0.45550464 0.55433799 0.65835697 # 20 H20 0.51843070 0.55048034 0.57469287 # 21 H21 0.32985131 0.44243889 0.64114176 # 22 H22 0.31530498 0.37504864 0.54682075 # 23 H23 0.33174733 0.44218547 0.56760415 # 24 C1 0.20894717 0.53331689 0.36034256 # 25 C2 0.14349461 0.56113155 0.59675664 # 26 C3 0.40611149 0.40438849 0.36083655 # 27 C4 0.51731138 0.32978437 0.54186932 # 28 C5 0.29304912 0.64221861 0.52383485 # 29 C6 0.46404453 0.55368963 0.58585519 # 30 C7 0.42096625 0.45701750 0.53407684 # 31 Si1 0.26727418 0.52193324 0.52645807 # 32 Si2 0.24938239 0.48769863 0.42368522 # 33 O1 0.20314472 0.50951811 0.59584848 # 34 O2 0.43189819 0.46588258 0.42518984 # 35 O3 0.45762332 0.36118251 0.57014441 # 36 O4