@MOLECULE FDBD02179 31 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0184 1.5028 0.0103 C.3 1 UNK -0.0386 2 C1 0.0021 -0.0041 0.0020 C.ar 1 UNK -0.0336 3 C2 0.0057 -0.6883 -1.1977 C.ar 1 UNK -0.0155 4 C3 0.0240 -2.0751 -1.2056 C.ar 1 UNK 0.1299 5 C4 0.0387 -2.7765 -0.0087 C.ar 1 UNK -0.0184 6 C5 0.0351 -2.0946 1.1918 C.ar 1 UNK -0.0446 7 C6 0.0230 -0.7052 1.2009 C.ar 1 UNK 0.0107 8 S 0.0184 0.1664 2.7322 S.3 1 UNK -0.1283 9 C7 0.0324 -1.1677 3.9612 C.3 1 UNK -0.0134 10 O 0.0272 -2.7479 -2.3876 O.3 1 UNK -0.4261 11 P 1.4993 -3.0524 -2.9639 P.3 1 UNK 0.3609 12 S1 2.5527 -1.5221 -2.8169 S.2 1 UNK 0.0363 13 O1 2.1694 -4.2483 -2.1196 O.3 1 UNK -0.3050 14 C8 3.5658 -4.5478 -2.1680 C.3 1 UNK 0.0464 15 O2 1.3914 -3.4829 -4.5115 O.3 1 UNK -0.3050 16 C9 2.5177 -3.5168 -5.3903 C.3 1 UNK 0.0464 17 H -0.0184 1.8539 1.0210 H 1 UNK 0.0278 18 H1 -0.8993 1.8503 -0.4880 H 1 UNK 0.0278 19 H2 0.8479 1.8741 -0.4963 H 1 UNK 0.0278 20 H3 -0.0052 -0.1675 -2.0886 H 1 UNK 0.0657 21 H4 0.0523 -3.8084 -0.0157 H 1 UNK 0.0654 22 H5 0.0414 -2.6166 2.0820 H 1 UNK 0.0630 23 H6 0.0307 -0.7465 4.9448 H 1 UNK 0.0344 24 H7 0.9110 -1.7642 3.8302 H 1 UNK 0.0344 25 H8 -0.8362 -1.7794 3.8336 H 1 UNK 0.0344 26 H9 3.7748 -5.3787 -1.5271 H 1 UNK 0.0529 27 H10 4.1248 -3.6959 -1.8413 H 1 UNK 0.0529 28 H11 3.8434 -4.7930 -3.1719 H 1 UNK 0.0529 29 H12 2.2018 -3.8314 -6.3630 H 1 UNK 0.0529 30 H13 3.2449 -4.2044 -5.0118 H 1 UNK 0.0529 31 H14 2.9498 -2.5400 -5.4542 H 1 UNK 0.0529 @BOND 1 1 2 1 2 2 7 ar 3 2 3 ar 4 3 4 ar 5 4 5 ar 6 4 10 1 7 5 6 ar 8 6 7 ar 9 7 8 1 10 8 9 1 11 10 11 1 12 11 12 2 13 11 13 1 14 11 15 1 15 13 14 1 16 15 16 1 17 1 17 1 18 1 18 1 19 1 19 1 20 3 20 1 21 5 21 1 22 6 22 1 23 9 23 1 24 9 24 1 25 9 25 1 26 14 26 1 27 14 27 1 28 14 28 1 29 16 29 1 30 16 30 1 31 16 31 1