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 2 4 16 3 Direct 0.55976133 0.46131557 0.52412450 # 1 Sn 0.76167284 0.55128448 0.24312322 # 2 N1 0.58677350 0.44974594 0.65448368 # 3 N2 0.81973036 0.56425812 0.31680065 # 4 C1 0.69328252 0.61596220 0.23167472 # 5 C2 0.58858630 0.52677149 0.71056825 # 6 C3 0.55384421 0.37599999 0.69940184 # 7 C4 0.78831997 0.56039151 0.37933659 # 8 H1 0.86877143 0.51500810 0.31321017 # 9 H2 0.85208627 0.62872914 0.31514005 # 10 H3 0.72415497 0.67609419 0.21841798 # 11 H4 0.65221921 0.62510602 0.28741935 # 12 H5 0.64900618 0.60128561 0.17749137 # 13 H6 0.39322561 0.48798443 0.50540557 # 14 H7 0.55404493 0.33440137 0.41807506 # 15 H9 0.62302130 0.57927724 0.68045306 # 16 H10 0.52497228 0.55372883 0.72992387 # 17 H11 0.62274010 0.50906693 0.76858262 # 18 H12 0.59526229 0.36214011 0.75643547 # 19 H13 0.55401285 0.31981892 0.65439244 # 20 H14 0.48897853 0.38520052 0.72571641 # 21 H15 0.73775307 0.48431852 0.23938898 # 22 H16 0.61605216 0.56841803 0.43311565 # 23 H17 0.44582495 0.51366666 0.47931772 # 24 O1 0.57428942 0.33989983 0.47679012 # 25 O2 0.64657864 0.52819228 0.46897204 # 26 O3