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 0.70026442 0.45287441 0.59257137 # 1 N 0.72412012 0.45772854 0.65637220 # 2 H2 0.74210296 0.44826727 0.54896181 # 3 H3 0.15073299 0.51716930 0.36689926 # 4 H4 0.20680227 0.61055728 0.36813977 # 5 H5 0.22080731 0.52015998 0.29290450 # 6 H6 0.11014349 0.54901577 0.65741247 # 7 H7 0.14992707 0.63767529 0.59820425 # 8 H8 0.10621083 0.55202460 0.53849634 # 9 H9 0.41955135 0.43040336 0.29444864 # 10 H10 0.41875626 0.34034117 0.37247224 # 11 H11 0.34579747 0.40906504 0.35894633 # 12 H12 0.52756533 0.27134273 0.57334979 # 13 H13 0.53172016 0.35104955 0.47855672 # 14 H14 0.57869914 0.40615345 0.58858241 # 15 H15 0.24705916 0.69003393 0.50456394 # 16 H16 0.30454172 0.66666044 0.59136669 # 17 H17 0.32957358 0.65561037 0.47793959 # 18 H18 0.44074054 0.61810386 0.55848416 # 19 H19 0.45016694 0.55579097 0.65875068 # 20 H20 0.51315434 0.55106858 0.57515313 # 21 H21 0.32431087 0.44569731 0.64125579 # 22 H22 0.30927560 0.37778226 0.54744011 # 23 H23 0.32616386 0.44485887 0.56772490 # 24 C1 0.20362227 0.53737446 0.36052299 # 25 C2 0.13839171 0.56566690 0.59673493 # 26 C3 0.40089809 0.40877045 0.35990052 # 27 C4 0.51946269 0.34131560 0.55011013 # 28 C5 0.28793737 0.64523728 0.52476275 # 29 C6 0.45889433 0.55488181 0.58639059 # 30 C7 0.41520780 0.45895231 0.53390022 # 31 Si1 0.26172986 0.52511895 0.52639798 # 32 Si2 0.24425871 0.49135390 0.42343945 # 33 O1 0.19738562 0.51259812 0.59523786 # 34 O2 0.42608321 0.46959312 0.42518587 # 35 O3 0.45219659 0.36202966 0.56832924 # 36 O4