No title 1.0 15.00000000 0.00000000 0.00000000 0.00000000 15.00000000 0.00000000 0.00000000 0.00000000 15.00000000 Sn N C H O 1 3 6 21 2 Direct 0.56302063 0.53258013 0.47860510 # 1 Sn 0.63010877 0.63533559 0.42137828 # 2 N1 0.58466183 0.52564360 0.61286193 # 3 N2 0.60607914 0.41716200 0.42150650 # 4 N3 0.71955119 0.62314707 0.38660897 # 5 C1 0.58340065 0.71114367 0.38366325 # 6 C2 0.62666309 0.60067779 0.65778983 # 7 C3 0.51902646 0.48057862 0.66843552 # 8 C4 0.59050442 0.40669521 0.32613302 # 9 C5 0.59547039 0.33370094 0.47038255 # 10 C6 0.75070190 0.56292558 0.41450060 # 11 H1 0.72053361 0.61684029 0.31281488 # 12 H2 0.76232183 0.68083104 0.40395855 # 13 H3 0.61667497 0.77443504 0.40211560 # 14 H4 0.51424322 0.71403329 0.40778382 # 15 H5 0.58091600 0.70849874 0.30972182 # 16 H6 0.40266480 0.58684249 0.50255636 # 17 H7 0.30567882 0.38053729 0.40705149 # 18 H8 0.37372427 0.44855615 0.44640694 # 19 H9 0.67209716 0.63596630 0.61234453 # 20 H10 0.57817756 0.65006680 0.68421884 # 21 H11 0.66635839 0.57637292 0.71506970 # 22 H12 0.55205884 0.45191629 0.72787757 # 23 H13 0.48687473 0.42541142 0.63233026 # 24 H14 0.46551213 0.52546029 0.69307283 # 25 H15 0.59886842 0.47083376 0.29142144 # 26 H16 0.64020671 0.35981398 0.29835200 # 27 H17 0.52343942 0.38020647 0.31001511 # 28 H18 0.52827389 0.30393212 0.46314107 # 29 H19 0.60914487 0.34416942 0.54166580 # 30 H20 0.64479224 0.28481178 0.44544829 # 31 H21 0.43063967 0.55525650 0.45310865 # 32 O1 0.35311254 0.38593999 0.45079782 # 33 O2