No title 1.0 30.00000000 0.00000000 0.00000000 0.00000000 20.00000000 0.00000000 0.00000000 0.00000000 15.00000000 C Si O N H 6 10 8 6 42 Direct 0.21015107 0.52777263 0.31842847 # 1 C1 0.26220101 0.39749565 0.26911406 # 2 C2 0.13188641 0.45655037 0.21935370 # 3 C3 0.64938869 0.63831318 0.49468612 # 4 C4 0.55277478 0.58036729 0.49447239 # 5 C5 0.60017430 0.77508092 0.49466353 # 6 C6 0.26380990 0.49058347 0.27599928 # 7 Si1 0.16358102 0.53628960 0.23727934 # 8 Si2 0.35534963 0.53995144 0.35228444 # 9 Si3 0.44490847 0.47537140 0.35353928 # 10 Si4 0.36982681 0.42251988 0.47792281 # 11 Si5 0.61013399 0.57384488 0.44583452 # 12 Si6 0.64748506 0.72474731 0.44944174 # 13 Si7 0.64084960 0.42106325 0.44262169 # 14 Si8 0.57579434 0.32022168 0.37270964 # 15 Si9 0.57102635 0.36645720 0.56741566 # 16 Si10 0.27698276 0.52485278 0.17901469 # 17 O1 0.30381422 0.51057262 0.34753937 # 18 O2 0.18794142 0.56218682 0.14271023 # 19 O3 0.12792773 0.59722488 0.26366794 # 20 O4 0.60889879 0.58201937 0.33554683 # 21 O5 0.62991347 0.49933674 0.47083998 # 22 O6 0.64305117 0.71385140 0.33945229 # 23 O7 0.69505646 0.76546268 0.46511935 # 24 O8 0.39025522 0.47700031 0.39423701 # 25 N1 0.34089426 0.46122637 0.56199925 # 26 N2 0.46821586 0.55498777 0.36191983 # 27 N3 0.59546959 0.36942128 0.46144976 # 28 N4 0.60574098 0.38476244 0.65396874 # 29 N5 0.61102716 0.25724729 0.33555877 # 30 N6 0.19851163 0.49892188 0.37682975 # 31 H1 0.21796334 0.57881928 0.34244597 # 32 H2 0.25114350 0.54402943 0.14771593 # 33 H3 0.25714448 0.37493738 0.33517085 # 34 H4 0.29399549 0.37875416 0.24251236 # 35 H5 0.23544010 0.38057399 0.22464021 # 36 H6 0.10529772 0.46252869 0.16910378 # 37 H7 0.11640250 0.43861597 0.28163585 # 38 H8 0.15455506 0.41694580 0.19565045 # 39 H9 0.16970015 0.58499043 0.09980075 # 40 H10 0.09984995 0.58554311 0.28985408 # 41 H11 0.37189852 0.56003163 0.26152002 # 42 H12 0.35462505 0.59881284 0.41333321 # 43 H13 0.46939517 0.42162380 0.40743099 # 44 H14 0.44704975 0.45939732 0.25711907 # 45 H15 0.33853109 0.37388810 0.43641688 # 46 H16 0.40937603 0.38888565 0.51571852 # 47 H17 0.30911526 0.47706445 0.55104443 # 48 H18 0.35724060 0.49072443 0.60591702 # 49 H19 0.49037443 0.57175631 0.31224285 # 50 H20 0.47414885 0.57723603 0.42136222 # 51 H21 0.64600303 0.63977294 0.56799980 # 52 H22 0.68307399 0.61850953 0.48184525 # 53 H23 0.62078226 0.62546599 0.31515022 # 54 H24 0.55285344 0.56937333 0.56627490 # 55 H25 0.52993268 0.54408977 0.46315675 # 56 H26 0.53842819 0.63114174 0.48423835 # 57 H27 0.59940907 0.82534985 0.46486447 # 58 H28 0.60205216 0.78051091 0.56783795 # 59 H29 0.56825683 0.75055015 0.47907019 # 60 H30 0.65131698 0.75141469 0.30158927 # 61 H31 0.69566379 0.80130974 0.51025428 # 62 H32 0.65237741 0.41648744 0.34638871 # 63 H33 0.67993534 0.40096968 0.49746535 # 64 H34 0.53433008 0.28831455 0.40551205 # 65 H35 0.56779543 0.36293652 0.29341772 # 66 H36 0.53349684 0.41594495 0.57344415 # 67 H37 0.55358388 0.29659852 0.57936919 # 68 H38 0.61272529 0.43320362 0.66981195 # 69 H39 0.63314678 0.35584861 0.66773562 # 70 H40 0.63568356 0.26872749 0.29116364 # 71 H41 0.62054159 0.21991935 0.37696247 # 72 H42