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 0.57415457 0.48468992 0.49790880 # 1 Sn 0.67497747 0.52552878 0.35027701 # 2 N1 0.63254551 0.51333473 0.61419182 # 3 N2 0.75501620 0.56400956 0.37733789 # 4 C1 0.62074478 0.57353719 0.29090053 # 5 C2 0.59199251 0.56718384 0.67935576 # 6 C3 0.67540682 0.44729094 0.65446517 # 7 C4 0.77830279 0.53721574 0.43326229 # 8 H1 0.79765218 0.55059515 0.32778666 # 9 H2 0.75579717 0.63407960 0.39061691 # 10 H3 0.65766284 0.58278918 0.23801438 # 11 H4 0.60114441 0.63225350 0.31291693 # 12 H5 0.56064760 0.54337702 0.27148544 # 13 H6 0.40966681 0.51403078 0.48576350 # 14 H7 0.57758782 0.33635170 0.43058380 # 15 H9 0.63563416 0.61028534 0.70602838 # 16 H10 0.54050771 0.60866658 0.65812985 # 17 H11 0.56932256 0.52799359 0.72790504 # 18 H12 0.72251588 0.47319904 0.69983291 # 19 H13 0.70582200 0.40784119 0.60389178 # 20 H14 0.63607622 0.40827134 0.69344136 # 21 H15 0.68182193 0.42065439 0.32146693 # 22 H16 0.64242863 0.37059347 0.31015521 # 23 H17 0.46092302 0.55126875 0.48404018 # 24 O1 0.55367705 0.35741903 0.48262400 # 25 O2 0.66293658 0.37560568 0.36537884 # 26 O3