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 0.57595373 0.48761172 0.49463183 # 1 Sn 0.66414054 0.52230931 0.36367124 # 2 N1 0.63826701 0.52128332 0.60915534 # 3 N2 0.74692694 0.56397849 0.38490505 # 4 C1 0.61167756 0.56823407 0.29830376 # 5 C2 0.59241829 0.57223539 0.67545420 # 6 C3 0.69060215 0.45620230 0.64884808 # 7 C4 0.77705064 0.53431877 0.44000300 # 8 H1 0.78876228 0.55504353 0.32960872 # 9 H2 0.74376103 0.63474841 0.40005152 # 10 H3 0.64935133 0.57112605 0.24046393 # 11 H4 0.59476006 0.63314693 0.31610412 # 12 H5 0.54960277 0.53613845 0.28323470 # 13 H6 0.41172196 0.51728658 0.48330824 # 14 H7 0.58053068 0.33659550 0.43214740 # 15 H9 0.63721076 0.61416136 0.70922529 # 16 H10 0.54244964 0.61553380 0.64915559 # 17 H11 0.56264537 0.53035942 0.72282034 # 18 H12 0.73842258 0.48708141 0.69275759 # 19 H13 0.72479815 0.41884397 0.59757919 # 20 H14 0.65446343 0.41115519 0.68940698 # 21 H15 0.67483054 0.41269637 0.33172668 # 22 H16 0.64572568 0.34586540 0.29478516 # 23 H17 0.46281028 0.55596901 0.48463048 # 24 O1 0.55110050 0.35960893 0.48335324 # 25 O2 0.66498132 0.35653235 0.35242969 # 26 O3