@MOLECULE 119025994 47 46 1 SMALL USER_CHARGES @ATOM 1 Sn1 -0.4693 -0.0690 0.1586 Sn 1 noname 0.3491 2 O1 1.4464 -0.3769 -0.4141 O.3 1 noname -0.2715 3 O2 3.6427 -0.0342 -0.0517 O.2 1 noname -0.2662 4 C1 -0.8837 2.0233 0.1591 C.3 1 noname -0.0479 5 C2 -1.7849 -1.0541 -1.2010 C.3 1 noname -0.0479 6 C3 -0.7590 -0.8517 2.1215 C.3 1 noname -0.0507 7 C4 -0.6758 2.5848 -1.2489 C.3 1 noname -0.0578 8 C5 -3.2337 -0.8212 -0.7678 C.3 1 noname -0.0578 9 C6 -4.1774 -1.5278 -1.7431 C.3 1 noname -0.0541 10 C7 -0.9731 4.0856 -1.2485 C.3 1 noname -0.0541 11 C8 -0.4617 -2.3526 2.1211 C.3 1 noname -0.0699 12 C9 -5.6262 -1.2950 -1.3099 C.3 1 noname -0.0562 13 C10 -0.7653 4.6470 -2.6565 C.3 1 noname -0.0562 14 C11 2.4590 0.1560 0.3022 C.2 1 noname 0.1093 15 C12 -1.0625 6.1479 -2.6561 C.3 1 noname -0.0654 16 C13 -6.5699 -2.0016 -2.2851 C.3 1 noname -0.0654 17 C14 2.1716 0.9544 1.4903 C.3 1 noname 0.0202 18 H1 -1.9158 2.1892 0.4677 H 1 noname 0.0202 19 H2 -1.5731 -2.1233 -1.2013 H 1 noname 0.0202 20 H3 -1.6368 -0.6541 -2.2041 H 1 noname 0.0202 21 H4 -0.2114 2.5267 0.8539 H 1 noname 0.0202 22 H5 -1.7912 -0.6858 2.4301 H 1 noname 0.0199 23 H6 -0.0867 -0.3483 2.8163 H 1 noname 0.0199 24 H7 -1.3482 2.0814 -1.9437 H 1 noname 0.0260 25 H8 0.3563 2.4189 -1.5575 H 1 noname 0.0260 26 H9 -3.3818 -1.2212 0.2353 H 1 noname 0.0260 27 H10 -3.4455 0.2480 -0.7676 H 1 noname 0.0260 28 H11 -2.0053 4.2515 -0.9399 H 1 noname 0.0266 29 H12 -0.3008 4.5890 -0.5537 H 1 noname 0.0266 30 H13 -3.9656 -2.5970 -1.7433 H 1 noname 0.0266 31 H14 -4.0293 -1.1278 -2.7462 H 1 noname 0.0266 32 H15 -0.6098 -2.7525 3.1242 H 1 noname 0.0224 33 H16 -1.1341 -2.8559 1.4264 H 1 noname 0.0224 34 H17 0.5704 -2.5184 1.8126 H 1 noname 0.0224 35 H18 -5.7743 -1.6950 -0.3068 H 1 noname 0.0264 36 H19 -5.8380 -0.2258 -1.3096 H 1 noname 0.0264 37 H20 -1.4376 4.1437 -3.3513 H 1 noname 0.0264 38 H21 0.2669 4.4812 -2.9651 H 1 noname 0.0264 39 H22 -0.9145 6.5479 -3.6592 H 1 noname 0.0230 40 H23 -2.0947 6.3138 -2.3475 H 1 noname 0.0230 41 H24 -0.3902 6.6513 -1.9614 H 1 noname 0.0230 42 H25 -7.6021 -1.8357 -1.9765 H 1 noname 0.0230 43 H26 -6.3581 -3.0708 -2.2854 H 1 noname 0.0230 44 H27 -6.4218 -1.6016 -3.2882 H 1 noname 0.0230 45 H28 2.6354 0.4905 2.3607 H 1 noname 0.0335 46 H29 1.0932 1.0092 1.6391 H 1 noname 0.0335 47 H30 2.5717 1.9597 1.3579 H 1 noname 0.0335 @BOND 1 1 2 1 2 1 4 1 3 1 5 1 4 1 6 1 5 2 14 1 6 3 14 2 7 4 7 1 8 4 18 1 9 4 21 1 10 5 8 1 11 5 19 1 12 5 20 1 13 6 11 1 14 6 22 1 15 6 23 1 16 7 10 1 17 7 24 1 18 7 25 1 19 8 9 1 20 8 26 1 21 8 27 1 22 9 12 1 23 9 30 1 24 9 31 1 25 10 13 1 26 10 28 1 27 10 29 1 28 11 32 1 29 11 33 1 30 11 34 1 31 12 16 1 32 12 35 1 33 12 36 1 34 13 15 1 35 13 37 1 36 13 38 1 37 14 17 1 38 15 39 1 39 15 40 1 40 15 41 1 41 16 42 1 42 16 43 1 43 16 44 1 44 17 45 1 45 17 46 1 46 17 47 1 @SUBSTRUCTURE 1 noname 1