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 0.21535970 0.52674829 0.32683382 # 1 C1 0.26724036 0.39657065 0.27740565 # 2 C2 0.13687502 0.45562425 0.22777437 # 3 C3 0.64272821 0.64211360 0.48632652 # 4 C4 0.54727546 0.58214785 0.48538884 # 5 C5 0.59525133 0.77586895 0.48650759 # 6 C6 0.26834469 0.48913859 0.28424528 # 7 Si1 0.16869619 0.53543084 0.24569398 # 8 Si2 0.36023843 0.53850545 0.36160594 # 9 Si3 0.44982231 0.47149072 0.36392923 # 10 Si4 0.37463877 0.42181661 0.48788462 # 11 Si5 0.60534591 0.57478159 0.43736863 # 12 Si6 0.64141017 0.72712938 0.44042446 # 13 Si7 0.63565482 0.42067205 0.43573091 # 14 Si8 0.57245209 0.32155395 0.36669348 # 15 Si9 0.56554347 0.36853920 0.56019376 # 16 Si10 0.28202951 0.52386383 0.18806519 # 17 O1 0.30750248 0.50882539 0.35592516 # 18 O2 0.19300377 0.56100403 0.15084683 # 19 O3 0.13297208 0.59636362 0.27195954 # 20 O4 0.60390297 0.58225438 0.32525667 # 21 O5 0.62458472 0.49903933 0.46128709 # 22 O6 0.63827541 0.71427902 0.33150277 # 23 O7 0.68917443 0.76513135 0.45696448 # 24 O8 0.39468645 0.47531600 0.40452968 # 25 N1 0.34575866 0.46104315 0.57036113 # 26 N2 0.47664256 0.55429279 0.36564266 # 27 N3 0.58976040 0.36958677 0.45030685 # 28 N4 0.60117892 0.38615717 0.64581536 # 29 N5 0.60539650 0.25866769 0.32714336 # 30 N6 0.20346367 0.49808847 0.38505617 # 31 H1 0.22301169 0.57784241 0.35086946 # 32 H2 0.25631509 0.54302144 0.15635558 # 33 H3 0.26220996 0.37403378 0.34323422 # 34 H4 0.29901208 0.37799823 0.25088585 # 35 H5 0.24069595 0.37959631 0.23316962 # 36 H6 0.11034123 0.46158528 0.17737015 # 37 H7 0.12147711 0.43758186 0.29022445 # 38 H8 0.15983835 0.41620648 0.20416635 # 39 H9 0.17478866 0.58413861 0.10801523 # 40 H10 0.10503352 0.58485071 0.29809138 # 41 H11 0.37594140 0.55926658 0.26976791 # 42 H12 0.35978501 0.59756987 0.42137998 # 43 H13 0.47583118 0.41796066 0.41906912 # 44 H14 0.45248339 0.46279922 0.26821796 # 45 H15 0.34370370 0.37292503 0.44369869 # 46 H16 0.41506145 0.38806086 0.52281435 # 47 H17 0.31382764 0.47567173 0.55852090 # 48 H18 0.36309211 0.48941133 0.61392738 # 49 H19 0.49884961 0.57340939 0.31911914 # 50 H20 0.48104866 0.57664034 0.43543203 # 51 H21 0.64028667 0.64083071 0.56007671 # 52 H22 0.67504004 0.61706708 0.47058641 # 53 H23 0.61633634 0.62737047 0.30649000 # 54 H24 0.54566324 0.56815470 0.55759994 # 55 H25 0.52645921 0.54529944 0.45359332 # 56 H26 0.53248616 0.63491056 0.47518696 # 57 H27 0.59468470 0.82572228 0.45655131 # 58 H28 0.59697590 0.78134072 0.55943937 # 59 H29 0.56377294 0.75095358 0.47066037 # 60 H30 0.64609236 0.75232233 0.29439078 # 61 H31 0.69050574 0.80186935 0.50137618 # 62 H32 0.64745525 0.41785132 0.33735814 # 63 H33 0.67478214 0.40178239 0.48894736 # 64 H34 0.52920332 0.28985721 0.39744428 # 65 H35 0.56237926 0.36445689 0.28427697 # 66 H36 0.52864415 0.41624250 0.56481778 # 67 H37 0.54869823 0.29758422 0.57073270 # 68 H38 0.60719845 0.43368361 0.66079549 # 69 H39 0.62755571 0.35658029 0.65876961 # 70 H40 0.63060377 0.26983128 0.28279658 # 71 H41 0.61529697 0.22097695 0.36891820 # 72 H42